| Year |
Citation |
Score |
| 2024 |
Paul I, Konieczny KA, Chavez R, Shan JR, Houk KN, Garcia-Garibay MA. Cascade Photoreaction in Crystals: A Phase Change Caused by a Dewar Benzene Quantum Chain Triggers a Topochemical [2 + 2] Photodimerization. Journal of the American Chemical Society. PMID 39377489 DOI: 10.1021/jacs.4c09377 |
0.588 |
|
| 2024 |
Arnold RE, Saska J, Mesquita-Ribeiro R, Dajas-Bailador F, Taylor L, Lewis W, Argent S, Shao H, Houk KN, Denton RM. Total synthesis, biological evaluation and biosynthetic re-evaluation of -derived neolignans. Chemical Science. 15: 11783-11793. PMID 39092111 DOI: 10.1039/d4sc03232b |
0.598 |
|
| 2024 |
Williams CG, Nistanaki SK, Dong K, Lee W, Houk KN, Nelson HM. Main Group-Catalyzed Cationic Claisen Rearrangements via Vinyl Carbocations. Organic Letters. PMID 38842928 DOI: 10.1021/acs.orglett.4c00837 |
0.368 |
|
| 2024 |
De Abreu M, Rogge T, Lanzi M, Saiegh TJ, Houk KN, Wencel-Delord J. Cyclic Diaryl λ -Bromanes as a Precursor for Regiodivergent Alkynylation Reactions. Angewandte Chemie (International Ed. in English). e202319960. PMID 38375976 DOI: 10.1002/anie.202319960 |
0.347 |
|
| 2023 |
Qin ZY, Gao S, Zou Y, Liu Z, Wang JB, Houk KN, Arnold FH. Biocatalytic Construction of Chiral Pyrrolidines and Indolines via Intramolecular C(sp)-H Amination. Acs Central Science. 9: 2333-2338. PMID 38161360 DOI: 10.1021/acscentsci.3c00516 |
0.674 |
|
| 2023 |
Chen YH, Duan M, Lin SL, Liu YW, Cheng JK, Xiang SH, Yu P, Houk KN, Tan B. Organocatalytic aromatization-promoted umpolung reaction of imines. Nature Chemistry. PMID 38062248 DOI: 10.1038/s41557-023-01384-x |
0.673 |
|
| 2023 |
Shao H, Adebomi V, Bruce A, Raj M, Houk KN. Intramolecular Hydrogen Bonding Enables a Zwitterionic Mechanism for Macrocyclic Peptide Formation: Computational Mechanistic Studies of CyClick Chemistry. Angewandte Chemie (International Ed. in English). e202307210. PMID 37475575 DOI: 10.1002/anie.202307210 |
0.583 |
|
| 2023 |
Hejna BG, Ganley JM, Shao H, Tian H, Ellefsen JD, Fastuca NJ, Houk KN, Miller SJ, Knowles RR. Catalytic Asymmetric Hydrogen Atom Transfer: Enantioselective Hydroamination of Alkenes. Journal of the American Chemical Society. PMID 37432783 DOI: 10.1021/jacs.3c04591 |
0.601 |
|
| 2023 |
Kleinmans R, Dutta S, Ozols K, Shao H, Schäfer F, Thielemann RE, Chan HT, Daniliuc CG, Houk KN, Glorius F. -Selective Dearomative [2π + 2σ] Photocycloadditions of Bicyclic Aza-Arenes. Journal of the American Chemical Society. PMID 37232562 DOI: 10.1021/jacs.3c02961 |
0.636 |
|
| 2023 |
Fasan R, Roy S, Vargas D, Ma P, Sengupta A, Houk K. Stereoselective Construction of β-, γ-, and δ-Lactam Rings via Enzymatic C-H Amidation. Research Square. PMID 36711830 DOI: 10.21203/rs.3.rs-2429100/v1 |
0.811 |
|
| 2023 |
Alcock E, Mackey P, Turlik A, Bhatt K, Light M, Houk K, McGlacken GP. The Double Aldol-Tishchenko Reaction of Butanone, Cyclobutanone and a 3-Pentanone Derived Sulfinylimine and DFT Calculations of the Stereo-determining Step. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 36617506 DOI: 10.1002/chem.202203029 |
0.318 |
|
| 2022 |
Liu WD, Lee W, Shu H, Xiao C, Xu H, Chen X, Houk KN, Zhao J. Diastereoselective Radical Aminoacylation of Olefins through N-Heterocyclic Carbene Catalysis. Journal of the American Chemical Society. PMID 36423331 DOI: 10.1021/jacs.2c11209 |
0.612 |
|
| 2022 |
Vidal L, Chen PP, Nicolas E, Hackett A, Robertson CM, Houk KN, Aïssa C. Enantioselective Intramolecular Iridium-Catalyzed Cyclopropanation of α-Carbonyl Sulfoxonium Ylides. Organic Letters. PMID 36367970 DOI: 10.1021/acs.orglett.2c03396 |
0.321 |
|
| 2022 |
Gao S, Duan M, Andreola LR, Yu P, Wheeler SE, Houk KN, Chen M. Unusual Enantiodivergence in Chiral Brønsted Acid-Catalyzed Asymmetric Allylation with β-Alkenyl Allylic Boronates. Angewandte Chemie (International Ed. in English). PMID 35989224 DOI: 10.1002/anie.202208908 |
0.749 |
|
| 2022 |
Murray KA, Evans D, Hughes MP, Sawaya MR, Hu CJ, Houk KN, Eisenberg D. Extended β-Strands Contribute to Reversible Amyloid Formation. Acs Nano. PMID 35132852 DOI: 10.1021/acsnano.1c08043 |
0.773 |
|
| 2022 |
Yahiaoui O, Murray LAM, Zhao F, Moore BS, Houk KN, Liu F, George JH. A Diazo-Hooker Reaction, Inspired by the Biosynthesis of Azamerone. Organic Letters. PMID 34994200 DOI: 10.1021/acs.orglett.1c03810 |
0.403 |
|
| 2021 |
Sato M, Kishimoto S, Yokoyama M, Jamieson CS, Narita K, Maeda N, Hara K, Hashimoto H, Tsunematsu Y, Houk KN, Tang Y, Watanabe K. Catalytic mechanism and -to- selectivity reversion of an octalin-forming natural Diels-Alderase. Nature Catalysis. 4: 223-232. PMID 35873532 DOI: 10.1038/s41929-021-00577-2 |
0.757 |
|
| 2021 |
Houk KN, Duan M, Díaz-Oviedo CD, Zhou Y, Chen X, Yu P, List B, Lan Y. Chiral Phosphoric Acid Catalyzed Conversion of Epoxides into Thiiranes: Mechanism, Stereochemical Model, and New Catalyst Design. Angewandte Chemie (International Ed. in English). PMID 34889494 DOI: 10.1002/anie.202113204 |
0.774 |
|
| 2021 |
Su J, Mo JN, Chen X, Umanzor A, Zhang Z, Houk KN, Zhao J. Generation of Oxyphosphonium Ions by Photoredox/Cobaloxime Catalysis for Scalable Amide and Peptide Synthesis in Batch and Continuous-Flow. Angewandte Chemie (International Ed. in English). PMID 34783121 DOI: 10.1002/anie.202112668 |
0.591 |
|
| 2021 |
Gao S, Duan M, Liu J, Yu P, Houk KN, Chen M. Stereochemical Control via Chirality Pairing: Stereodivergent Syntheses of Enantioenriched Homoallylic Alcohols. Angewandte Chemie (International Ed. in English). 60: 24096-24106. PMID 34608723 DOI: 10.1002/anie.202107004 |
0.602 |
|
| 2021 |
Solea AB, Wang S, Xue XS, Crochet A, Fromm KM, Houk KN, Mamula O, Allemann C. Efficient synthesis of isoindolones by intramolecular cyclisation of pyridinylbenzoic acids. Organic & Biomolecular Chemistry. PMID 34477627 DOI: 10.1039/d1ob01343b |
0.75 |
|
| 2021 |
Houk KN, Zhang H, Thøgersen MK, Jamieson CS, Xue XS, Jørgensen KA. Ambimodal Transition States in Diels-Alder Cycloadditions of Tropolone and Tropolonate with N-Methylmaleimide. Angewandte Chemie (International Ed. in English). PMID 34472178 DOI: 10.1002/anie.202109608 |
0.828 |
|
| 2021 |
Wang RB, Ma SG, Jamieson CS, Gao RM, Liu YB, Li Y, Wang XJ, Li YH, Houk KN, Qu J, Yu SS. Library construction of stereochemically diverse isomers of spirooliganin: their total synthesis and antiviral activity. Chemical Science. 12: 7003-7011. PMID 34123328 DOI: 10.1039/d1sc01277k |
0.726 |
|
| 2021 |
Ramirez M, Svatunek D, Liu F, Garg NK, Houk KN. Origins of Endo Selectivity in Diels-Alder Reactions of Cyclic Allene Dienophiles. Angewandte Chemie (International Ed. in English). PMID 33851504 DOI: 10.1002/anie.202101809 |
0.698 |
|
| 2021 |
Ohashi M, Kakule TB, Tang MC, Jamieson CS, Liu M, Zhao YL, Houk KN, Tang Y. Biosynthesis of Cyclophane-Containing Hirsutellone Family of Fungal Natural Products. Journal of the American Chemical Society. PMID 33834778 DOI: 10.1021/jacs.1c00098 |
0.76 |
|
| 2021 |
Zheng YL, Pei-Pei X, Daneshfar O, Houk K, Hong X, Newman SG. Direct Synthesis of Ketones from Methyl Esters by Nickel-Catalyzed Suzuki-Miyaura Coupling. Angewandte Chemie (International Ed. in English). PMID 33792138 DOI: 10.1002/anie.202103327 |
0.309 |
|
| 2021 |
Chen PP, Ma P, He X, Svatunek D, Liu F, Houk KN. Computational Exploration of Ambiphilic Reactivity of Azides and Sustmann's Paradigmatic Parabola. The Journal of Organic Chemistry. PMID 33769821 DOI: 10.1021/acs.joc.1c00239 |
0.792 |
|
| 2021 |
Ma J, Chen S, Bellotti P, Guo R, Schäfer F, Heusler A, Zhang X, Daniliuc C, Brown MK, Houk KN, Glorius F. Photochemical intermolecular dearomative cycloaddition of bicyclic azaarenes with alkenes. Science (New York, N.Y.). 371: 1338-1345. PMID 33766881 DOI: 10.1126/science.abg0720 |
0.369 |
|
| 2021 |
Svatunek D, Hansen T, Houk KN, Hamlin TA. How the Lewis Base F Catalyzes the 1,3-Dipolar Cycloaddition between Carbon Dioxide and Nitrilimines. The Journal of Organic Chemistry. PMID 33577314 DOI: 10.1021/acs.joc.0c02963 |
0.627 |
|
| 2021 |
Wang ZJ, Chen X, Wu L, Wong JJ, Liang Y, Zhao Y, Houk KN, Shi Z. Metal-Free Directed C-H Borylation of Pyrroles. Angewandte Chemie (International Ed. in English). PMID 33449421 DOI: 10.1002/anie.202016573 |
0.575 |
|
| 2021 |
Einsiedler M, Jamieson CS, Maskeri M, Houk KN, Gulder TAM. Fungal Dioxygenase AsqJ Is Promiscuous and Bimodal: Substrate-Directed Formation of Quinolones versus Quinazolinones. Angewandte Chemie (International Ed. in English). PMID 33411393 DOI: 10.1002/anie.202017086 |
0.799 |
|
| 2020 |
Wang D, Li M, Chen X, Wang M, Liang Y, Zhao Y, Houk KN, Shi Z. Palladium-Catalyzed Silacyclization of (Hetero)Arenes with a Tetrasilane Reagent through Twofold C-H Activation. Angewandte Chemie (International Ed. in English). PMID 33377224 DOI: 10.1002/anie.202015117 |
0.583 |
|
| 2020 |
Li B, Tang H, Turlik A, Wan Z, Xue XS, Li L, Yang X, Li J, He G, Houk KN, Chen G. Cooperative Stapling of Native Peptides at Lysine and Tyrosine or Arginine with Formaldehyde. Angewandte Chemie (International Ed. in English). PMID 33338303 DOI: 10.1002/anie.202016267 |
0.681 |
|
| 2020 |
Saha I, Dang EK, Svatunek D, Houk KN, Harran PG. Computational generation of an annotated gigalibrary of synthesizable, composite peptidic macrocycles. Proceedings of the National Academy of Sciences of the United States of America. PMID 32948694 DOI: 10.1073/Pnas.2007304117 |
0.659 |
|
| 2020 |
Lowder L, Zhao F, Vaughan MM, Houk KN, Liu F, Wu J. Diversification of Nucleophile-Intercepted Beckmann Fragmentation (NuBFr) Products and Related DFT Studies. The Journal of Organic Chemistry. PMID 32786611 DOI: 10.1021/Acs.Joc.0C01486 |
0.366 |
|
| 2020 |
Houk KN, Liu F, Yang Z, Seeman JI. Evolution of the Diels-Alder Reaction Mechanism Since the 1930s: Woodward, Houk with Woodward, and the Influence of Computational Chemistry on Understanding Cycloadditions. Angewandte Chemie (International Ed. in English). PMID 32662195 DOI: 10.1002/Anie.202001654 |
0.688 |
|
| 2020 |
Liepuoniute I, Sanders JN, Garcia-Garibay MA, Houk KN. Computational Investigation into Ligand Effects on Correlated Geared Dynamics in Dirhodium Supramolecular Gears - Insights Be-yond the NMR Experimental Window. The Journal of Organic Chemistry. PMID 32478513 DOI: 10.1021/Acs.Joc.0C01230 |
0.545 |
|
| 2020 |
Wang Y, Zhang C, Zhao YL, Zhao R, Houk KN. Understand the Specific Regio- and Enantioselectivity of Fluostatin Conjugation in the Post-Biosynthesis. Biomolecules. 10. PMID 32466453 DOI: 10.3390/biom10060815 |
0.564 |
|
| 2020 |
Houk KN, Liu F, Chen Y. Huisgen's 1,3-Dipolar Cycloadditions to Fulvenes via Ambimodal [6+4]/[4+2] Transition States. Angewandte Chemie (International Ed. in English). PMID 32384185 DOI: 10.1002/Anie.202005265 |
0.441 |
|
| 2020 |
Seeman JI, Chen PP, Houk KN. Rolf Huisgen's Classic Studies of Cyclic Triene Diels-Alder Reactions Elaborated by Modern Computational Analysis. Angewandte Chemie (International Ed. in English). PMID 32369676 DOI: 10.1002/Anie.202003279 |
0.474 |
|
| 2020 |
Bähr S, Brinkmann-Chen S, Garcia-Borràs M, Roberts JM, Katsoulis DE, Houk KN, Arnold FH. Selective Enzymatic Oxidation of Silanes to Silanols. Angewandte Chemie (International Ed. in English). PMID 32212229 DOI: 10.1002/Anie.202002861 |
0.335 |
|
| 2020 |
Xie S, Sundhoro M, Houk KN, Yan M. Electrophilic Azides for Materials Synthesis and Chemical Biology. Accounts of Chemical Research. PMID 32207916 DOI: 10.1021/Acs.Accounts.0C00046 |
0.337 |
|
| 2020 |
Athavale SV, Simon A, Houk KN, Denmark SE. Demystifying the asymmetry-amplifying, autocatalytic behaviour of the Soai reaction through structural, mechanistic and computational studies. Nature Chemistry. PMID 32203445 DOI: 10.1038/S41557-020-0421-8 |
0.437 |
|
| 2020 |
Gao S, Duan M, Houk K, Chen M. Chiral Phosphoric Acid Dual-Function Catalysis: Asymmetric Allylation with α-Vinyl Allylboron Reagents. Angewandte Chemie (International Ed. in English). PMID 32173972 DOI: 10.1002/Anie.202000039 |
0.362 |
|
| 2020 |
Shi H, Lu Y, Weng J, Bay KL, Chen X, Tanaka K, Verma P, Houk KN, Yu JQ. Differentiation and functionalization of remote C-H bonds in adjacent positions. Nature Chemistry. PMID 32123338 DOI: 10.1038/S41557-020-0424-5 |
0.792 |
|
| 2020 |
Svatunek D, Pemberton RP, Mackey JL, Liu P, Houk KN. Concerted [4+2] and Stepwise (2+2) Cycloadditions of Tetrafluoroethylene with Butadiene: DFT and DLPNO-UCCSD(T) Explorations. The Journal of Organic Chemistry. PMID 32031811 DOI: 10.1021/Acs.Joc.0C00222 |
0.816 |
|
| 2020 |
Chen S, Wong J, Houk KN. Mechanism of the Manolikakes Enamide-Based Domino Reaction for the Stereospecific Construction of Tetrahydropyrans. The Journal of Organic Chemistry. PMID 32017561 DOI: 10.1021/Acs.Joc.9B03440 |
0.345 |
|
| 2020 |
Yu JQ, Fan Z, Bay KL, Chen X, Zhuang Z, Park HS, Yeung KS, Houk KN. Rational Development of Remote C-H Functionalization of Biphenyl: Experimental and Computational Studies. Angewandte Chemie (International Ed. in English). PMID 31943648 DOI: 10.1002/Anie.201915624 |
0.802 |
|
| 2020 |
Low ZJ, Ma GL, Tran HT, Zou Y, Xiong J, Pang L, Nuryyeva S, Ye H, Hu JF, Houk KN, Liang ZX. Sungeidines from a non-canonical enediyne biosynthetic pathway. Journal of the American Chemical Society. PMID 31922407 DOI: 10.1021/Jacs.9B10086 |
0.628 |
|
| 2020 |
Yan Y, Zang X, Jamieson CS, Lin H, Houk KN, Zhou J, Tang Y. Biosynthesis of the fungal glyceraldehyde-3-phosphate dehydrogenase inhibitor heptelidic acid and mechanism of self-resistance Chemical Science. 11: 9554-9562. DOI: 10.1039/D0Sc03805A |
0.676 |
|
| 2020 |
Chen Y, Zhang X, Liu F, He G, Zhang J, Houk KN, Smith AB, Liang Y. The role of CuI in the siloxane-mediated Pd-catalyzed cross-coupling reactions of aryl iodides with aryl lithium reagents Chinese Chemical Letters. DOI: 10.1016/J.Cclet.2020.05.009 |
0.373 |
|
| 2020 |
Castro AC, Romero‐Rivera A, Osuna S, Houk KN, Swart M. Cover Feature: Computational NMR Spectra of
o
‐Benzyne and Stable Guests and Their Hemicarceplexes (Chem. Eur. J. 12/2020) Chemistry – a European Journal. 26: 2517-2517. DOI: 10.1002/Chem.201905504 |
0.425 |
|
| 2019 |
Liu L, Shi T, Houk KN, Zhao YL. Understanding the R882H mutation effects of DNA methyltransferase DNMT3A: a combination of molecular dynamics simulations and QM/MM calculations. Rsc Advances. 9: 31425-31434. PMID 35527972 DOI: 10.1039/c9ra06791d |
0.498 |
|
| 2019 |
Mu X, Axtell JC, Bernier NA, Kirlikovali KO, Jung D, Umanzor A, Qian K, Chen X, Bay KL, Kirollos M, Rheingold AL, Houk KN, Spokoyny AM. Sterically Unprotected Nucleophilic Boron Cluster Reagents. Chem. 5: 2461-2469. PMID 32292833 DOI: 10.1016/J.Chempr.2019.07.018 |
0.803 |
|
| 2019 |
He CQ, Lam CC, Yu P, Song Z, Chen M, Lam YH, Chen S, Houk KN. Catalytic Effects of Ammonium and Sulfonium Salts and External Electric Fields on Aza-Diels-Alder Reactions. The Journal of Organic Chemistry. PMID 31891501 DOI: 10.1021/Acs.Joc.9B03446 |
0.662 |
|
| 2019 |
McLeod D, Thøgersen MK, Jessen NI, Jørgensen KA, Jamieson CS, Xue XS, Houk KN, Liu F, Hoffmann R. Expanding the Frontiers of Higher-Order Cycloadditions. Accounts of Chemical Research. PMID 31789016 DOI: 10.1021/Acs.Accounts.9B00498 |
0.829 |
|
| 2019 |
Quintela-Varela H, Jamieson C, Shao Q, Houk K, Trauner D. Bioinspired Synthesis of (-)-PF-1018. Angewandte Chemie (International Ed. in English). PMID 31788926 DOI: 10.1002/Anie.201912452 |
0.809 |
|
| 2019 |
Castro A, Romero-Rivera A, Osuna S, Houk KN, Swart M. COMPUTATIONAL NMR SPECTRA OF o-BENZYNE AND STABLE GUESTS AND THEIR HEMICARCEPLEXES. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 31765503 DOI: 10.1002/Chem.201904756 |
0.473 |
|
| 2019 |
Lv J, Chen X, Xue XS, Zhao B, Liang Y, Wang M, Jin L, Yuan Y, Han Y, Zhao Y, Lu Y, Zhao J, Sun WY, Houk KN, Shi Z. Metal-free directed sp-C-H borylation. Nature. 575: 336-340. PMID 31723273 DOI: 10.1038/S41586-019-1640-2 |
0.791 |
|
| 2019 |
Levandowski BJ, Svatunek D, Sohr B, Mikula H, Houk KN. Correction to "Secondary Orbital Interactions Enhance the Reactivity of Alkynes in Diels-Alder Cycloadditions". Journal of the American Chemical Society. 141: 18641. PMID 31692340 DOI: 10.1021/Jacs.9B11320 |
0.645 |
|
| 2019 |
Yao Y, An C, Evans D, Liu W, Wang W, Wei G, Ding N, Houk KN, Gao SS. A Catalase Involved in the Oxidative Cyclization of the Tetracyclic Ergoline of Fungal Ergot Alkaloids. Journal of the American Chemical Society. PMID 31621316 DOI: 10.1021/jacs.9b10217 |
0.794 |
|
| 2019 |
Lv J, Chen X, Xue XS, Zhao B, Liang Y, Wang M, Jin L, Yuan Y, Han Y, Zhao Y, Lu Y, Zhao J, Sun WY, Houk KN, Shi Z. Metal-free directed C-H bond activation and borylation. Nature. PMID 31569198 DOI: 10.1038/s41586-019-1640-2 |
0.57 |
|
| 2019 |
Fu XP, Xue XS, Zhang XY, Xiao YL, Zhang S, Guo YL, Leng X, Houk KN, Zhang X. Controllable catalytic difluorocarbene transfer enables access to diversified fluoroalkylated arenes. Nature Chemistry. 11: 948-956. PMID 31548670 DOI: 10.1038/S41557-019-0331-9 |
0.726 |
|
| 2019 |
Dan Q, Newmister SA, Klas KR, Fraley AE, McAfoos TJ, Somoza AD, Sunderhaus JD, Ye Y, Shende VV, Yu F, Sanders JN, Brown WC, Zhao L, Paton RS, Houk KN, et al. Fungal indole alkaloid biogenesis through evolution of a bifunctional reductase/Diels-Alderase. Nature Chemistry. PMID 31548667 DOI: 10.1038/S41557-019-0326-6 |
0.572 |
|
| 2019 |
Zheng H, Sang Y, Houk KN, Xue XS, Cheng JP. Mechanism and Origins of Enantioselectivities in Spirobiindane-based Hypervalent Iodine(III) Induced Asymmetric Dearomatizing Spirolactonizations. Journal of the American Chemical Society. PMID 31514501 DOI: 10.1021/Jacs.9B08243 |
0.731 |
|
| 2019 |
Duan A, Fell JS, Yu P, Lam CY, Gravel M, Houk KN. Theoretical Study of Diastereoselective NHC-Catalyzed Cross-Benzoin Reactions between Furfural and N-Boc-Protected α-Amino Aldehydes. The Journal of Organic Chemistry. PMID 31512872 DOI: 10.1021/Acs.Joc.9B01821 |
0.627 |
|
| 2019 |
Le Fouler V, Chen Y, Gandon V, Bizet V, Salome C, Fessard T, Liu F, Houk KN, Blanchard N. Activating pyrimidines by pre-distortion for the general synthesis of 7-aza-indazoles from 2-hydrazonylpyrimidines via intramolecular Diels-Alder reactions. Journal of the American Chemical Society. PMID 31475527 DOI: 10.1021/Jacs.9B07037 |
0.432 |
|
| 2019 |
Chen Q, Gao J, Jamieson C, Liu J, Ohashi M, Bai J, Yan D, Liu B, Che Y, Wang Y, Houk KN, Hu Y. Enzymatic Intermolecular Hetero-Diels-Alder Reaction in the Biosynthesis of Tropolonic Sesquiterpenes. Journal of the American Chemical Society. PMID 31461283 DOI: 10.1021/Jacs.9B06592 |
0.747 |
|
| 2019 |
Cai Y, Hai Y, Ohashi M, Jamieson CS, Garcia-Borras M, Houk KN, Zhou J, Tang Y. Structural basis for stereoselective dehydration and hydrogen-bonding catalysis by the SAM-dependent pericyclase LepI. Nature Chemistry. PMID 31332284 DOI: 10.2210/Pdb6Ix9/Pdb |
0.785 |
|
| 2019 |
Zou Y, Chen S, Houk KN. Origins of Selective Formation of 5-Vinyl-2-Methylene Furans from Oxyallyl/Diene (3+2) Cycloadditions with Pd(0) Catalysis. Journal of the American Chemical Society. PMID 31328520 DOI: 10.1021/Jacs.9B05762 |
0.65 |
|
| 2019 |
Zou Y, Xue XS, Deng Y, Smith AB, Houk KN. Factors Controlling Reactivity in the Hydrogen Atom Transfer and Radical Addition Steps of a Radical Relay Cascade. Organic Letters. PMID 31305084 DOI: 10.1021/Acs.Orglett.9B02023 |
0.795 |
|
| 2019 |
Svatunek D, Houk KN. autoDIAS: a python tool for an automated distortion/interaction activation strain analysis. Journal of Computational Chemistry. PMID 31281990 DOI: 10.1002/Jcc.26023 |
0.631 |
|
| 2019 |
Machovina MM, Mallinson SJB, Knott BC, Meyers AW, Garcia-Borràs M, Bu L, Gado JE, Oliver A, Schmidt GP, Hinchen DJ, Crowley MF, Johnson CW, Neidle EL, Payne CM, Houk KN, et al. Enabling microbial syringol conversion through structure-guided protein engineering. Proceedings of the National Academy of Sciences of the United States of America. PMID 31235604 DOI: 10.1073/pnas.1820001116 |
0.334 |
|
| 2019 |
Moore LC, Lo A, Fell JS, Duong MR, Moreno JA, Rich BE, Bravo M, Fettinger JC, Souza LW, Olmstead MM, Houk KN, Shaw JT. Acyclic Stereocontrol in the Additions of Nucleophilic Alkenes to α-Chiral N-Sulfonyl Imines. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 31226239 DOI: 10.1002/Chem.201902790 |
0.324 |
|
| 2019 |
Cai L, Zhang K, Chen S, Lepage RJ, Houk KN, Krenske EH, Kwon O. Catalytic Asymmetric Staudinger-aza-Wittig Reaction for the Synthesis of Heterocyclic Amines. Journal of the American Chemical Society. PMID 31184143 DOI: 10.1021/Jacs.9B04803 |
0.644 |
|
| 2019 |
Liu K, Kurukulasuriya R, Dykstra K, DiMichelle L, Liu J, Vachal P, Ogawa A, DeVita RJ, Shen DM, Tan Q, Chen Y, Gauthier D, Verras A, Crespo A, Zamlynny B, ... ... Houk KN, et al. Development of indazole mineralocorticoid receptor antagonists and investigation into their selective late-stage functionalization. Bioorganic & Medicinal Chemistry Letters. PMID 31104995 DOI: 10.1016/J.Bmcl.2019.04.024 |
0.596 |
|
| 2019 |
Tu J, Svatunek D, Parvez S, Liu AC, Levandowski BJ, Eckvahl HJ, Peterson RT, Houk KN, Franzini RM. Stable, Reactive and Orthogonal Tetrazines: Dispersion Forces Promote the Cycloaddition with Isonitriles. Angewandte Chemie (International Ed. in English). PMID 31062496 DOI: 10.1002/Anie.201903877 |
0.704 |
|
| 2019 |
Zhang Z, Jamieson CS, Zhao YL, Li D, Ohashi M, Houk KN, Tang Y. Enzyme-catalyzed inverse-electron demand Diels-Alder reaction in the biosynthesis of antifungal ilicicolin H. Journal of the American Chemical Society. PMID 30905148 DOI: 10.1021/Jacs.9B02204 |
0.791 |
|
| 2019 |
Zhang B, Wang KB, Wang W, Wang X, Liu F, Zhu J, Shi J, Li LY, Han H, Xu K, Qiao HY, Zhang X, Jiao RH, Houk KN, Liang Y, et al. Enzyme-catalysed [6+4] cycloadditions in the biosynthesis of natural products. Nature. PMID 30867595 DOI: 10.1038/S41586-019-1021-X |
0.489 |
|
| 2019 |
Yamano M, Knapp R, Ngamnithiporn A, Ramirez M, Houk K, Stoltz B, Garg NK. Cycloadditions of Oxacyclic Allenes and a Catalytic Asym-metric Entryway to Enantioenriched Cyclic Allenes. Angewandte Chemie (International Ed. in English). PMID 30811080 DOI: 10.1002/Anie.201900503 |
0.383 |
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| 2019 |
Deng Y, Nguyen MD, Zou Y, Houk KN, Smith AB. Generation of Dithianyl and Dioxolanyl Radicals Using Photoredox Catalysis: Application in the Total Synthesis of the Danshenspiroketallactones via Radical Relay Chemistry. Organic Letters. PMID 30807194 DOI: 10.1021/Acs.Orglett.9B00271 |
0.659 |
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| 2019 |
Hamlin TA, Levandowski BJ, Narsaria AK, Houk KN, Bickelhaupt FM. Structural Distortion of Cycloalkynes Influences Cycloaddition Rates Both By Strain and Interaction Energies. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 30779472 DOI: 10.1002/Chem.201900295 |
0.612 |
|
| 2019 |
Cleary SE, Li X, Yang LC, Houk KN, Hong X, Brewer M. Reactivity Profiles of Diazo Amides, Esters, and Ketones in Transition-Metal-Free C-H Insertion Reactions. Journal of the American Chemical Society. PMID 30758200 DOI: 10.1021/Jacs.8B12420 |
0.314 |
|
| 2019 |
Bertuzzi G, Thøgersen MK, Giardinetti M, Vidal-Albalat A, Simon A, Houk KN, Jørgensen KA. Catalytic Enantioselective Hetero-[6+4] and -[6+2] Cycloadditions for the Construction of Condensed Polycyclic Pyrroles, Imidazoles, and Pyrazoles. Journal of the American Chemical Society. 141: 3288-3297. PMID 30746938 DOI: 10.1021/Jacs.8B13659 |
0.39 |
|
| 2019 |
Levandowski BJ, Svatunek D, Sohr B, Mikula H, Houk KN. Secondary Orbital Interactions Enhance the Reactivity of Alkynes in Diels-Alder Cycloadditions. Journal of the American Chemical Society. 141: 2224-2227. PMID 30693769 DOI: 10.1021/Jacs.8B13088 |
0.685 |
|
| 2019 |
Chen M, He CQ, Houk KN. Mechanism and Regioselectivity of an Unsymmetrical Hexadehydro-Diels-Alder (HDDA) Reaction. The Journal of Organic Chemistry. PMID 30672703 DOI: 10.1021/Acs.Joc.8B02865 |
0.432 |
|
| 2019 |
Yen-Pon E, Champagne PA, Plougastel L, Gabillet S, Thuery P, Johnson M, Muller G, Pieters G, Taran F, Houk KN, Audisio D. Sydnone-based Approach to Hetero-helicenes Through 1,3-Dipolar-Cycloadditions. Journal of the American Chemical Society. PMID 30628450 DOI: 10.1021/Jacs.8B11465 |
0.36 |
|
| 2019 |
Levandowski BJ, Hamlin TA, Eckvahl HJ, Bickelhaupt FM, Houk KN. Diels-Alder reactivities of cycloalkenediones with tetrazine. Journal of Molecular Modeling. 25: 33. PMID 30627945 DOI: 10.1007/S00894-018-3909-Z |
0.575 |
|
| 2019 |
Xue XS, Jamieson CS, Garcia-Borràs M, Dong X, Yang Z, Houk KN. An Ambimodal Trispericyclic Transition State and Dynamic Control of Periselectivity. Journal of the American Chemical Society. PMID 30623652 DOI: 10.1021/Jacs.8B12674 |
0.812 |
|
| 2019 |
Tan D, Jamieson CS, Ohashi M, Tang MC, Houk KN, Tang Y. Genome-mined Diels-Alderase catalyzes formation of the cis-octahydrodecalins of varicidin A and B. Journal of the American Chemical Society. PMID 30609896 DOI: 10.1021/Jacs.8B12010 |
0.746 |
|
| 2019 |
Yang Z, Jamieson CS, Xue X, Garcia-Borràs M, Benton T, Dong X, Liu F, Houk K. Mechanisms and Dynamics of Reactions Involving Entropic Intermediates Trends in Chemistry. 1: 22-34. DOI: 10.1016/j.trechm.2019.01.009 |
0.811 |
|
| 2019 |
Lee GY, Bay KL, Houk KN. Evaluation of DFT Methods and Implicit Solvation Models for Anion‐Binding Host‐Guest Systems Helvetica Chimica Acta. 102. DOI: 10.1002/Hlca.201900032 |
0.757 |
|
| 2019 |
Hamlin TA, Levandowski BJ, Narsaria AK, Houk KN, Bickelhaupt FM. Cover Feature: Structural Distortion of Cycloalkynes Influences Cycloaddition Rates both by Strain and Interaction Energies (Chem. Eur. J. 25/2019) Chemistry – a European Journal. 25: 6249-6249. DOI: 10.1002/Chem.201900867 |
0.557 |
|
| 2019 |
Tu J, Svatunek D, Parvez S, Liu AC, Levandowski BJ, Eckvahl HJ, Peterson RT, Houk KN, Franzini RM. Back Cover: Stable, Reactive, and Orthogonal Tetrazines: Dispersion Forces Promote the Cycloaddition with Isonitriles (Angew. Chem. Int. Ed. 27/2019) Angewandte Chemie International Edition. 58: 9290-9290. DOI: 10.1002/Anie.201906875 |
0.639 |
|
| 2019 |
Tu J, Svatunek D, Parvez S, Liu AC, Levandowski BJ, Eckvahl HJ, Peterson RT, Houk KN, Franzini RM. Rücktitelbild: Stable, Reactive, and Orthogonal Tetrazines: Dispersion Forces Promote the Cycloaddition with Isonitriles (Angew. Chem. 27/2019) Angewandte Chemie. 131: 9390-9390. DOI: 10.1002/Ange.201906875 |
0.639 |
|
| 2018 |
Caddell Haatveit K, Garcia-Borràs M, Houk KN. Computational Protocol to Understand P450 Mechanisms and Design of Efficient and Selective Biocatalysts. Frontiers in Chemistry. 6: 663. PMID 30687699 DOI: 10.3389/Fchem.2018.00663 |
0.369 |
|
| 2018 |
Fereyduni E, Sanders JN, Gonzalez G, Houk KN, Grenning AJ. Transient [3,3] Cope rearrangement of 3,3-dicyano-1,5-dienes: computational analysis and 2-step synthesis of arylcycloheptanes. Chemical Science. 9: 8760-8764. PMID 30627397 DOI: 10.1039/C8Sc03057J |
0.355 |
|
| 2018 |
Suh SE, Chen S, Houk KN, Chenoweth DM. The mechanism of the triple aryne-tetrazine reaction cascade: theory and experiment. Chemical Science. 9: 7688-7693. PMID 30542547 DOI: 10.1039/C8Sc01796D |
0.357 |
|
| 2018 |
Shao Z, Liu W, Tao H, Liu F, Zeng R, Champagne PA, Cao Y, Houk KN, Liang Y. Bioorthogonal release of sulfonamides and mutually orthogonal liberation of two drugs. Chemical Communications (Cambridge, England). PMID 30480281 DOI: 10.1039/C8Cc08533A |
0.3 |
|
| 2018 |
Chen S, Yu P, Houk KN. Ambimodal Dipolar/Diels-Alder Cycloaddition Transition States Involving Proton Transfers. Journal of the American Chemical Society. PMID 30479123 DOI: 10.1021/Jacs.8B11080 |
0.645 |
|
| 2018 |
Bay KL, Yang YF, Houk KN. Computational Exploration of a Pd(II)-Catalyzed γ-C-H Arylation where Stereoselectivity Arises from Attractive Aryl-Aryl Interactions. The Journal of Organic Chemistry. PMID 30403854 DOI: 10.1021/acs.joc.8b02416 |
0.796 |
|
| 2018 |
Levandowski BJ, Zou L, Houk KN. Hyperconjugative Aromaticity and Antiaromaticity Control the Reactivities and π-Facial Stereoselectivities of 5-Substituted Cyclopentadiene Diels-Alder Cycloadditions. The Journal of Organic Chemistry. PMID 30395708 DOI: 10.1021/Acs.Joc.8B02537 |
0.597 |
|
| 2018 |
Shi Z, Wang D, Xue XS, Houk K. Mild Ring-Opening 1,3-Hydroborations of Non-Activated Cyclopropanes. Angewandte Chemie (International Ed. in English). PMID 30370972 DOI: 10.1002/Anie.201811036 |
0.76 |
|
| 2018 |
Zhou B, Haj MK, Jacobsen EN, Houk KN, Xue XS. Mechanism and Origins of Chemo- and Stereoselectivities of Aryl Iodide-Catalyzed Asymmetric Difluorinations of β-Substituted Styrenes. Journal of the American Chemical Society. PMID 30350956 DOI: 10.1021/Jacs.8B05935 |
0.746 |
|
| 2018 |
Jamieson CS, Ohashi M, Liu F, Tang Y, Houk KN. The expanding world of biosynthetic pericyclases: cooperation of experiment and theory for discovery. Natural Product Reports. PMID 30311924 DOI: 10.1039/C8Np00075A |
0.767 |
|
| 2018 |
Haines BE, Nelson BM, Grandner JM, Kim J, Houk KN, Movassaghi M, Musaev DG. Mechanism of Permanganate-Promoted Dihydroxylation of Complex Diketopiperazines: Critical Roles of Counter-cation and Ion-Pairing. Journal of the American Chemical Society. PMID 30295476 DOI: 10.1021/Jacs.8B08371 |
0.703 |
|
| 2018 |
Yu P, He CQ, Simon A, Li W, Mose R, Thøgersen MK, Jørgensen KA, Houk KN. Organocatalytic 6+4 Cycloadditions via Zwitterionic Intermediates: Chemo-, Regio-, and Stereoselectivities. Journal of the American Chemical Society. PMID 30251535 DOI: 10.1021/Jacs.8B07575 |
0.682 |
|
| 2018 |
Xue XS, Levandowski BJ, He CQ, Houk KN. Origins of Selectivities in the Stork Diels-Alder Cycloaddition for the Synthesis of (±)-4-Methylenegermine. Organic Letters. PMID 30246539 DOI: 10.1021/acs.orglett.8b02548 |
0.705 |
|
| 2018 |
Zhang J, Yu P, Li SY, Sun H, Xiang SH, Wang JJ, Houk KN, Tan B. Asymmetric phosphoric acid-catalyzed four-component Ugi reaction. Science (New York, N.Y.). 361. PMID 30213886 DOI: 10.1126/Science.Aas8707 |
0.7 |
|
| 2018 |
Popov S, Shao B, Bagdasarian AL, Benton TR, Zou L, Yang Z, Houk KN, Nelson HM. Teaching an old carbocation new tricks: Intermolecular C-H insertion reactions of vinyl cations. Science (New York, N.Y.). 361: 381-387. PMID 30049877 DOI: 10.1126/science.aat5440 |
0.658 |
|
| 2018 |
Li G, Garcia-Borràs M, Fürst MJLJ, Ilie A, Fraaije MW, Houk KN, Reetz MT. Overriding Traditional Electronic Effects in Biocatalytic Baeyer-Villiger Reactions by Directed Evolution. Journal of the American Chemical Society. PMID 30044629 DOI: 10.1021/Jacs.8B04742 |
0.322 |
|
| 2018 |
Kishimoto S, Hara K, Hashimoto H, Hirayama Y, Champagne PA, Houk KN, Tang Y, Watanabe K. Enzymatic one-step ring contraction for quinolone biosynthesis. Nature Communications. 9: 2826. PMID 30026518 DOI: 10.1038/S41467-018-05221-5 |
0.415 |
|
| 2018 |
Mallinson SJB, Machovina MM, Silveira RL, Garcia-Borràs M, Gallup N, Johnson CW, Allen MD, Skaf MS, Crowley MF, Neidle EL, Houk KN, Beckham GT, DuBois JL, McGeehan JE. A promiscuous cytochrome P450 aromatic O-demethylase for lignin bioconversion. Nature Communications. 9: 2487. PMID 29950589 DOI: 10.1038/S41467-018-04878-2 |
0.32 |
|
| 2018 |
Lewis RD, Garcia-Borràs M, Chalkley MJ, Buller AR, Houk KN, Kan SBJ, Arnold FH. Catalytic iron-carbene intermediate revealed in a cytochrome carbene transferase. Proceedings of the National Academy of Sciences of the United States of America. PMID 29946033 DOI: 10.1073/Pnas.1807027115 |
0.356 |
|
| 2018 |
Gao SS, Zhang T, Garcia-Borràs M, Hung YS, Billingsley JM, Houk KN, Hu Y, Tang Y. Biosynthesis of Heptacyclic Duclauxins Requires Extensive Redox Modifications of the Phenalenone Aromatic Polyketide. Journal of the American Chemical Society. PMID 29741874 DOI: 10.1021/Jacs.8B03705 |
0.396 |
|
| 2018 |
Maiga-Wandiam B, Corbu A, Massiot G, Sautel F, Yu P, Lin BW, Houk KN, Cossy J. Intramolecular Diels-Alder approaches to the decalin core of verongidolide. The origin of the exo-selectivity: a DFT analysis. The Journal of Organic Chemistry. PMID 29715016 DOI: 10.1021/Acs.Joc.8B00566 |
0.674 |
|
| 2018 |
Scholl K, Dillashaw J, Timpy E, Lam YH, DeRatt L, Benton TR, Powell JP, Houk KN, Morgan JB. Quinine-Promoted, Enantioselective Boron-Tethered Diels-Alder Reaction by Anomeric Control of Transition State Conformation. The Journal of Organic Chemistry. PMID 29715015 DOI: 10.1021/Acs.Joc.8B00938 |
0.458 |
|
| 2018 |
Tao H, Liu F, Zeng R, Shao Z, Zou L, Cao Y, Murphy JM, Houk KN, Liang Y. Origins of halogen effects in bioorthogonal sydnone cycloadditions. Chemical Communications (Cambridge, England). PMID 29707720 DOI: 10.1039/C8Cc02128G |
0.57 |
|
| 2018 |
Goh SS, Champagne PA, Guduguntla S, Kikuchi T, Fujita M, Houk KN, Feringa BL. Stereospecific ring contraction of bromocycloheptenes through dyotropic rearrangements via non-classical carbocation-anion pairs. Journal of the American Chemical Society. PMID 29596748 DOI: 10.1021/Jacs.8B00821 |
0.351 |
|
| 2018 |
Chen S, Zheng Y, Cui T, Meggers E, Houk KN. Arylketone π-Conjugation Controls Enantioselectivity in Asymmetric Alkynylations Catalyzed by Centrochiral Ruthenium Complexes. Journal of the American Chemical Society. PMID 29577723 DOI: 10.1021/Jacs.8B00485 |
0.334 |
|
| 2018 |
Yang Z, Houk KN. The Dynamics of Chemical Reactions: Atomistic Visualizations of Organic Reactions, and Homage to van 't Hoff. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 29512895 DOI: 10.1002/chem.201706032 |
0.598 |
|
| 2018 |
Guan J, Jia C, Li Y, Liu Z, Wang J, Yang Z, Gu C, Su D, Houk KN, Zhang D, Guo X. Direct single-molecule dynamic detection of chemical reactions. Science Advances. 4: eaar2177. PMID 29487914 DOI: 10.1126/Sciadv.Aar2177 |
0.643 |
|
| 2018 |
Levandowski BJ, Hamlin TA, Helgeson RC, Bickelhaupt FM, Houk KN. Origins of the Endo and Exo Selectivities in Cyclopropenone, Iminocyclopropene, and Triafulvene Diels-Alder Cycloadditions. The Journal of Organic Chemistry. PMID 29470085 DOI: 10.1021/Acs.Joc.8B00025 |
0.666 |
|
| 2018 |
Wang X, Li Y, Knecht T, Daniliuc C, Houk K, Glorius F. Unprecedented Dearomatized Spirocyclopropane in a Sequential Rh(III)-catalyzed C-H Activation and Rearrangement Reaction. Angewandte Chemie (International Ed. in English). PMID 29461648 DOI: 10.1002/Anie.201800803 |
0.316 |
|
| 2018 |
Chen S, Houk KN. Origins of Stereoselectivity in Mannich Reactions Catalyzed by Chiral Vicinal Diamines. The Journal of Organic Chemistry. PMID 29439564 DOI: 10.1021/Acs.Joc.8B00037 |
0.449 |
|
| 2018 |
Yang Z, Dong X, Yu Y, Yu P, Li Y, Jamieson C, Houk KN. Relationships Between Product Ratios in Ambimodal Pericyclic Reactions and Bond Lengths in Transition Structures. Journal of the American Chemical Society. PMID 29419295 DOI: 10.1021/Jacs.7B13562 |
0.808 |
|
| 2018 |
Levandowski BJ, Herath D, Gallup NM, Houk KN. Origin of π-Facial Stereoselectivity in Thiophene 1-oxide Cycloadditions. The Journal of Organic Chemistry. PMID 29360357 DOI: 10.1021/Acs.Joc.7B03016 |
0.36 |
|
| 2018 |
Yang Z, Yang S, Yu P, Li Y, Doubleday C, Park J, Patel A, Jeon BS, Russell WK, Liu HW, Russell DH, Houk KN. Influence of water and enzyme SpnF on the dynamics and energetics of the ambimodal [6+4]/[4+2] cycloaddition. Proceedings of the National Academy of Sciences of the United States of America. PMID 29348209 DOI: 10.1073/Pnas.1719368115 |
0.805 |
|
| 2018 |
Yu Y, Yang Z, Houk KN. Molecular dynamics of the intramolecular 1, 3-dipolar ene reaction of a nitrile oxide and an alkene: non-statistical behavior of a reaction involving a diradical intermediate Molecular Physics. 117: 1360-1366. DOI: 10.1080/00268976.2018.1549338 |
0.627 |
|
| 2018 |
Luo S, Engle KM, Dong X, Hejl A, Takase MK, Henling LM, Liu P, Houk KN, Grubbs RH. An Initiation Kinetics Prediction Model Enables Rational Design of Ruthenium Olefin Metathesis Catalysts Bearing Modified Chelating Benzylidenes Acs Catalysis. 8: 4600-4611. DOI: 10.1021/acscatal.8b00843 |
0.535 |
|
| 2018 |
Yang Z, Zou L, Yu Y, Liu F, Dong X, Houk K. Molecular dynamics of the two-stage mechanism of cyclopentadiene dimerization: concerted or stepwise? Chemical Physics. 514: 120-125. DOI: 10.1016/j.chemphys.2018.02.020 |
0.53 |
|
| 2018 |
Houk KN, Caserio MC, Whitesides GM, Schuster DI, Dervan PB, Dougherty DA. J. D. Roberts Special Issue Journal of Physical Organic Chemistry. 31: e3886. DOI: 10.1002/Poc.3886 |
0.336 |
|
| 2018 |
Yang Z, Houk KN. Frontispiece: The Dynamics of Chemical Reactions: Atomistic Visualizations of Organic Reactions, and Homage to van ’t Hoff Chemistry - a European Journal. 24. DOI: 10.1002/chem.201881661 |
0.601 |
|
| 2017 |
Vogelsberg CS, Uribe-Romo FJ, Lipton AS, Yang S, Houk KN, Brown S, Garcia-Garibay MA. Ultrafast rotation in an amphidynamic crystalline metal organic framework. Proceedings of the National Academy of Sciences of the United States of America. PMID 29229859 DOI: 10.1073/Pnas.1708817115 |
0.539 |
|
| 2017 |
Hill DE, Bay KL, Yang YF, Plata RE, Takise R, Houk KN, Yu JQ, Blackmond DG. Dynamic Ligand Exchange as a Mechanistic Probe in Pd-Catalyzed Enantioselective C-H Functionalization Reactions Using Monoprotected Amino Acid Ligands. Journal of the American Chemical Society. PMID 29215885 DOI: 10.1021/Jacs.7B11962 |
0.799 |
|
| 2017 |
Yang YF, Yu P, Houk KN. Computational Exploration of Concerted and Zwitterionic Mechanisms of Diels-Alder Reactions between 1,2,3-Triazines and Enamines and Acceleration by Hydrogen-Bonding Solvents. Journal of the American Chemical Society. PMID 29161031 DOI: 10.1021/Jacs.7B08325 |
0.704 |
|
| 2017 |
Chen S, Huang X, Meggers E, Houk KN. Origins of Enantioselectivity in Asymmetric Radical Additions to Octahedral Chiral-at-Rhodium Enolates: A Computational Study. Journal of the American Chemical Society. PMID 29143527 DOI: 10.1021/Jacs.7B08650 |
0.398 |
|
| 2017 |
Kerisit N, Gawel P, Levandowski B, Yang YF, García-López V, Trapp N, Ruhlmann L, Boudon C, Houk KN, Diederich F. A Four-Step Synthesis of Substituted 5,11-Dicyano-6,12-diaryltetracenes with Enhanced Stability and High Fluorescence Emission. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 29139153 DOI: 10.1002/Chem.201703903 |
0.519 |
|
| 2017 |
Noey EL, Yang Z, Li Y, Yu H, Richey RN, Merritt JM, Kjell DP, Houk KN. Correction to Origins of Regioselectivity in the Fischer Indole Synthesis of a Selective Androgen Receptor Modulator. The Journal of Organic Chemistry. PMID 29072838 DOI: 10.1021/Acs.Joc.7B02416 |
0.768 |
|
| 2017 |
Liu F, Yang Z, Yu Y, Mei Y, Houk KN. Bimodal Evans-Polanyi Relationships in Dioxirane Oxidations of sp3 C-H: Non-Perfect Synchronization in Generation of Delocalized Radical Intermediates. Journal of the American Chemical Society. PMID 29069541 DOI: 10.1021/Jacs.7B07988 |
0.65 |
|
| 2017 |
Simmons BJ, Hoffmann M, Champagne PA, Picazo E, Yamakawa K, Morrill LA, Houk KN, Garg NK. Understanding and Interrupting the Fischer Azaindolization Reaction. Journal of the American Chemical Society. PMID 29022706 DOI: 10.1021/Jacs.7B07518 |
0.339 |
|
| 2017 |
Lin JB, Jin Y, Lopez SA, Druckerman N, Wheeler SE, Houk KN. Torsional Barriers to Rotation and Planarization in Heterocyclic Oligomers of Value in Organic Electronics. Journal of Chemical Theory and Computation. PMID 29016124 DOI: 10.1021/Acs.Jctc.7B00709 |
0.725 |
|
| 2017 |
He CQ, Yu P, Lam YH, Houk KN. Origins of Stereoselectivity in Chiral Aminoalcohol Catalysis of Oxyallyl Cation-Indole Reactions. Organic Letters. PMID 28976202 DOI: 10.1021/Acs.Orglett.7B02851 |
0.659 |
|
| 2017 |
Ohashi M, Liu F, Hai Y, Chen M, Tang MC, Yang Z, Sato M, Watanabe K, Houk KN, Tang Y. SAM-dependent enzyme-catalysed pericyclic reactions in natural product biosynthesis. Nature. PMID 28902839 DOI: 10.1038/Nature23882 |
0.706 |
|
| 2017 |
Champagne PA, Houk KN. The Influence of Endo- and Exocyclic Heteroatoms on Stabilities and 1,3-Dipolar Cycloaddition Reactivities of Mesoionic Azomethine Ylides and Imines. The Journal of Organic Chemistry. PMID 28876936 DOI: 10.1021/Acs.Joc.7B01928 |
0.363 |
|
| 2017 |
Liu F, Liang Y, Houk KN. Bioorthogonal Cycloadditions: Computational Analysis with the Distortion/Interaction Model and Predictions of Reactivities. Accounts of Chemical Research. PMID 28876890 DOI: 10.1021/Acs.Accounts.7B00265 |
0.39 |
|
| 2017 |
Grandner JM, Shao H, Grubbs RH, Liu P, Houk KN. The Origins of the Stereoretentive Mechanism of Olefin Metathesis with Ru-Dithiolate Catalysts. The Journal of Organic Chemistry. PMID 28841319 DOI: 10.1021/Acs.Joc.7B02129 |
0.619 |
|
| 2017 |
Zhang S, Taylor BLH, Ji CL, Gao Y, Harris MR, Hanna LE, Jarvo ER, Houk KN, Hong X. Mechanism and Origins of Ligand-controlled Stereoselectivity of Ni-Catalyzed Suzuki-Miyaura Coupling with Benzylic Esters: A Computational Study. Journal of the American Chemical Society. PMID 28838241 DOI: 10.1021/Jacs.7B04973 |
0.657 |
|
| 2017 |
Koch AA, Hansen DA, Shende VV, Furan LR, Houk KN, Jiménez-Osés G, Sherman DH. A single active site mutation in the pikromycin thioesterase generates a more effective macrocyclization catalyst. Journal of the American Chemical Society. PMID 28836768 DOI: 10.1021/Jacs.7B06436 |
0.648 |
|
| 2017 |
Park J, Chun S, Bobik TA, Houk KN, Yeates TO. Molecular Dynamics Simulations of Selective Metabolite Transport across the Propanediol Bacterial Microcompartment Shell. The Journal of Physical Chemistry. B. PMID 28829618 DOI: 10.1021/Acs.Jpcb.7B07232 |
0.548 |
|
| 2017 |
Fell JS, Lopez SA, Higginson CJ, Finn MG, Houk KN. Theoretical Analysis of the Retro-Diels-Alder Reactivity of Oxanorbornadiene Thiol and Amine Adducts. Organic Letters. PMID 28817292 DOI: 10.1021/Acs.Orglett.7B02064 |
0.698 |
|
| 2017 |
Fraley AE, Garcia-Borràs M, Tripathi A, Khare D, Mercado-Marin EV, Tran H, Dan Q, Webb G, Watts K, Crews P, Sarpong R, Williams RM, Smith JL, Houk KN, Sherman DH. Function and structure of MalA/MalA', iterative halogenases for late-stage C-H functionalization of indole alkaloids. Journal of the American Chemical Society. PMID 28777910 DOI: 10.1021/Jacs.7B06773 |
0.372 |
|
| 2017 |
Gao Y, Houk KN, Ho CY, Hong X. The mechanism and regioselectivities of (NHC)nickel(ii)hydride-catalyzed cycloisomerization of dienes: a computational study. Organic & Biomolecular Chemistry. PMID 28749518 DOI: 10.1039/C7Ob01494E |
0.325 |
|
| 2017 |
He CQ, Simon A, Lam YH, Brunskill APJ, Yasuda N, Tan J, Hyde AM, Sherer EC, Houk KN. A Model for the Enantioselectivity of Asymmetric Intramolecular Alkylations by bis-Quaternized Cinchona Alkaloid-Derived Catalysts. The Journal of Organic Chemistry. PMID 28731701 DOI: 10.1021/Acs.Joc.7B01577 |
0.343 |
|
| 2017 |
Levandowski BJ, Hamlin TA, Bickelhaupt FM, Houk KN. The Role of Orbital Interactions and Activation Strain (Distortion Energies) on Reactivities in the Normal and Inverse Electron-Demand Cycloadditions of Strained and Unstrained Cycloalkenes. The Journal of Organic Chemistry. PMID 28712288 DOI: 10.1021/Acs.Joc.7B01673 |
0.608 |
|
| 2017 |
Zhou CC, Hawthorne MF, Houk KN, Jiménez-Osés G. Multiple Mechanisms for the Thermal Decompositions of Metallaisoxazolin-5-ones from Computational Investigations. The Journal of Organic Chemistry. PMID 28703581 DOI: 10.1021/Acs.Joc.7B01169 |
0.643 |
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| 2017 |
Zhao J, Brosmer JL, Tang Q, Yang Z, Houk KN, Diaconescu PL, Kwon O. Intramolecular Crossed [2 + 2] Photocycloaddition Through Visible Light-Induced Energy Transfer. Journal of the American Chemical Society. PMID 28683547 DOI: 10.1021/Jacs.7B05277 |
0.611 |
|
| 2017 |
Simon A, Lam YH, Houk KN. Origins of Stereoselectivity of Enamine-Iminium Activated Nazarov Cyclizations by Vicinal Diamines. The Journal of Organic Chemistry. PMID 28678495 DOI: 10.1021/acs.joc.7b01606 |
0.309 |
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| 2017 |
Yang YF, Chen G, Hong X, Yu JQ, Houk KN. The Origins of Dramatic Differences in 5-Membered vs. 6-Membered Chelation of Pd(II) on Efficiency of C(sp(3))-H Bond Activation. Journal of the American Chemical Society. PMID 28578572 DOI: 10.1021/Jacs.7B01801 |
0.323 |
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| 2017 |
Grayson MN, Yang Z, Houk KN. Chronology of CH···O Hydrogen Bonding from Molecular Dynamics Studies of the Phosphoric Acid-Catalyzed Allylboration of Benzaldehyde. Journal of the American Chemical Society. PMID 28556660 DOI: 10.1021/jacs.7b03847 |
0.591 |
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| 2017 |
Yu P, Chen TQ, Yang Z, He CQ, Patel A, Lam YH, Liu CY, Houk KN. Mechanisms and Origins of Periselectivity of the Ambimodal [6+4] Cycloadditions of Tropone to Dimethylfulvene. Journal of the American Chemical Society. PMID 28535677 DOI: 10.1021/Jacs.7B02966 |
0.768 |
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| 2017 |
Yu P, Li W, Houk KN. Mechanisms and Origins of Selectivities of the Lewis Acid-Catalyzed Diels-Alder Reactions between Aryl Allenes and Acrylates. The Journal of Organic Chemistry. PMID 28510451 DOI: 10.1021/Acs.Joc.7B01132 |
0.71 |
|
| 2017 |
Li Y, Shan C, Yang YF, Shi FQ, Qi X, Houk KN, Lan Y. Mechanism, Regio-, and Diastereoselectivity of Rh(III)-catalyzed Cyclization Reactions of N-Arylnitrones with Alkynes: A DFT Study. The Journal of Physical Chemistry. A. PMID 28488866 DOI: 10.1021/Acs.Jpca.7B01020 |
0.704 |
|
| 2017 |
Noey EL, Yang Z, Li Y, Yu H, Richey RN, Merritt JM, Kjell DP, Houk KN. Origins of regioselectivity in the Fischer indole synthesis of a selective androgen receptor modulator. The Journal of Organic Chemistry. PMID 28467062 DOI: 10.1021/Acs.Joc.7B00878 |
0.817 |
|
| 2017 |
Banerjee S, Yang YF, Jenkins ID, Liang Y, Toutov AA, Liu WB, Schuman DP, Grubbs RH, Stoltz BM, Krenske EH, Houk KN, Zare RN. Ionic and Neutral Mechanisms for C-H Bond Silylation of Aromatic Heterocycles Catalyzed by Potassium t-Butoxide. Journal of the American Chemical Society. PMID 28462580 DOI: 10.1021/Jacs.6B13032 |
0.642 |
|
| 2017 |
Han X, Park J, Wu W, Malagon A, Wang L, Vargas E, Wikramanayake A, Houk KN, Leblanc RM. A resorcinarene for inhibition of Aβ fibrillation. Chemical Science. 8: 2003-2009. PMID 28451317 DOI: 10.1039/C6Sc04854D |
0.451 |
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| 2017 |
Bickelhaupt FM, Houk KN. Distortion/Interaction-Activation Strain Model to Analyze Reaction Rates. Angewandte Chemie (International Ed. in English). PMID 28447369 DOI: 10.1002/Anie.201701486 |
0.624 |
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| 2017 |
Ugur Marion I, Agopcan Cinar S, Dedeoglu B, Aviyente V, Hawthorne MF, Liu P, Liu F, Houk KN, Jiménez-Osés G. 1,3-Dipolar Cycloaddition Reactions of Low-Valent Rhodium and Iridium Complexes with Arylnitrile N-Oxides. The Journal of Organic Chemistry. PMID 28414468 DOI: 10.1021/Acs.Joc.7B00282 |
0.71 |
|
| 2017 |
Boon BA, Green AG, Liu P, Houk KN, Merlic CA. Using Ring Strain to Control 4π-Electrocyclization Reactions: Torquoselectivity in Ring-Closing of Medium-Ring Dienes and Ring-Opening of Bicyclic Cyclobutenes. The Journal of Organic Chemistry. PMID 28407711 DOI: 10.1021/Acs.Joc.7B00203 |
0.429 |
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| 2017 |
Li Y, He CQ, Gao FX, Li Z, Xue XS, Li X, Houk KN, Cheng JP. Design and Applications of N-tert-Butyl Sulfinyl Squaramide Catalysts. Organic Letters. PMID 28357868 DOI: 10.1021/Acs.Orglett.7B00727 |
0.688 |
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| 2017 |
Al-Bataineh N, Houk KN, Brewer M, Hong X. (2 + 1)-Cycloaddition Reactions Give Further Evidence of the Nitrenium-like Character of 1-Aza-2-azoniaallene Salts. The Journal of Organic Chemistry. PMID 28318256 DOI: 10.1021/Acs.Joc.7B00407 |
0.334 |
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| 2017 |
Gao SS, Garcia-Borràs M, Barber JS, Hai Y, Duan A, Garg NK, Houk KN, Tang Y. Enzyme-Catalyzed Intramolecular Enantioselective Hydroalkoxylation. Journal of the American Chemical Society. PMID 28240554 DOI: 10.1021/Jacs.7B01089 |
0.454 |
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| 2017 |
Fell JS, Martin BN, Houk KN. Origins of the unfavorable activation and reaction energies of 1-azadiene heterocycles compared to 2-azadiene heterocycles in Diels-Alder reactions. The Journal of Organic Chemistry. PMID 28150495 DOI: 10.1021/acs.joc.6b02524 |
0.303 |
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| 2017 |
Zou Y, Garcia-Borràs M, Tang MC, Hirayama Y, Li DH, Li L, Watanabe K, Houk KN, Tang Y. Enzyme-catalyzed cationic epoxide rearrangements in quinolone alkaloid biosynthesis. Nature Chemical Biology. PMID 28114276 DOI: 10.1038/Nchembio.2283 |
0.402 |
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| 2017 |
Duan A, Yu P, Liu F, Qiu H, Gu FL, Doyle MP, Houk KN. Diazo Esters as Dienophiles in Intramolecular (4+2) Cycloadditions: Computational Explorations of Mechanism. Journal of the American Chemical Society. PMID 28095697 DOI: 10.1021/Jacs.6B12371 |
0.707 |
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| 2017 |
Cherniawski BP, Lopez SA, Burnett EK, Yavuz I, Zhang L, Parkin SR, Houk KN, Briseno AL. The effect of hexyl side chains on molecular conformations, crystal packing, and charge transport of oligothiophenes Journal of Materials Chemistry C. 5: 582-588. DOI: 10.1039/C6Tc04612F |
0.636 |
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| 2017 |
Toutov AA, Salata M, Fedorov A, Yang Y, Liang Y, Cariou R, Betz KN, Couzijn EPA, Shabaker JW, Houk KN, Grubbs RH. A potassium tert-butoxide and hydrosilane system for ultra-deep desulfurization of fuels Nature Energy. 2. DOI: 10.1038/Nenergy.2017.8 |
0.33 |
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| 2017 |
Maji R, Champagne PA, Houk KN, Wheeler SE. Activation Mode and Origin of Selectivity in Chiral Phosphoric Acid-Catalyzed Oxacycle Formation by Intramolecular Oxetane Desymmetrizations Acs Catalysis. 7: 7332-7339. DOI: 10.1021/Acscatal.7B02993 |
0.806 |
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| 2017 |
Bickelhaupt FM, Houk KN. Inside Cover: Analyzing Reaction Rates with the Distortion/Interaction-Activation Strain Model (Angew. Chem. Int. Ed. 34/2017) Angewandte Chemie International Edition. 56: 10002-10002. DOI: 10.1002/Anie.201707253 |
0.51 |
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| 2017 |
Bickelhaupt FM, Houk KN. Innentitelbild: Das Distortion/Interaction-Activation-Strain-Modell zur Analyse von Reaktionsgeschwindigkeiten (Angew. Chem. 34/2017) Angewandte Chemie. 129: 10134-10134. DOI: 10.1002/Ange.201707253 |
0.438 |
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| 2017 |
Bickelhaupt FM, Houk KN. Das Distortion/Interaction-Activation-Strain-Modell zur Analyse von Reaktionsgeschwindigkeiten Angewandte Chemie. 129: 10204-10221. DOI: 10.1002/Ange.201701486 |
0.542 |
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| 2016 |
Narayanam MK, Liang Y, Houk KN, Murphy JM. Discovery of new mutually orthogonal bioorthogonal cycloaddition pairs through computational screening. Chemical Science. 7: 1257-1261. PMID 29910881 DOI: 10.1039/C5Sc03259H |
0.341 |
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| 2016 |
Grandner JM, Cacho RA, Tang Y, Houk KN. Mechanism of the P450-Catalyzed Oxidative Cyclization in the Biosynthesis of Griseofulvin. Acs Catalysis. 6: 4506-4511. PMID 28503354 DOI: 10.1021/acscatal.6b01068 |
0.363 |
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| 2016 |
Ben Halima T, Zhang W, Yalaoui I, Hong X, Yang YF, Houk KN, Newman SG. Palladium-Catalyzed Suzuki-Miyaura Coupling of Aryl Esters. Journal of the American Chemical Society. PMID 28001393 DOI: 10.1021/Jacs.6B12329 |
0.42 |
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| 2016 |
Simon A, Yeh AJ, Lam YH, Houk KN. Origins of Stereoselectivity of Chiral Vicinal Diamine-Catalyzed Aldol Reactions. The Journal of Organic Chemistry. 81: 12408-12415. PMID 27978746 DOI: 10.1021/acs.joc.6b02542 |
0.38 |
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| 2016 |
Levandowski BJ, Houk KN. Hyperconjugative, Secondary Orbital, Electrostatic, and Steric Effects on the Reactivities and Endo and Exo Stereoselectivities of Cyclopropene Diels-Alder Reactions. Journal of the American Chemical Society. 138: 16731-16736. PMID 27977194 DOI: 10.1021/jacs.6b10463 |
0.325 |
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| 2016 |
Krenske EH, Petter RC, Houk KN. Kinetics and Thermodynamics of Reversible Thiol Additions to Mono- and Diactivated Michael Acceptors: Implications for the Design of Drugs That Bind Covalently to Cysteines. The Journal of Organic Chemistry. 81: 11726-11733. PMID 27934455 DOI: 10.1021/Acs.Joc.6B02188 |
0.653 |
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| 2016 |
Simon RC, Busto E, Richter N, Resch V, Houk KN, Kroutil W. Biocatalytic trifluoromethylation of unprotected phenols. Nature Communications. 7: 13323. PMID 27834376 DOI: 10.1038/Ncomms13323 |
0.332 |
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| 2016 |
Garcia-Borràs M, Konishi A, Waterloo A, Liang Y, Cao Y, Hetzer C, Lehnherr D, Hampel F, Houk KN, Tykwinski RR. Tautomerization and Dimerization of 6,13-Disubstituted Derivatives of Pentacene. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 27786375 DOI: 10.1002/Chem.201604099 |
0.356 |
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| 2016 |
Gonzalez JA, Ogba OM, Morehouse GF, Rosson N, Houk KN, Leach AG, Cheong PH, Burke MD, Lloyd-Jones GC. MIDA boronates are hydrolysed fast and slow by two different mechanisms. Nature Chemistry. 8: 1067-1075. PMID 27768100 DOI: 10.1038/Nchem.2571 |
0.719 |
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| 2016 |
Li Z, Bally T, Houk KN, Borden WT. Variations in Rotational Barriers of Allyl and Benzyl Cations, Anions, and Radicals. The Journal of Organic Chemistry. PMID 27690443 DOI: 10.1021/Acs.Joc.6B01530 |
0.326 |
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| 2016 |
Yu X, Liu F, Zou Y, Tang MC, Hang L, Houk KN, Tang Y. Biosynthesis of Strained Piperazine Alkaloids - Uncovering the Concise Pathway of Herquline A. Journal of the American Chemical Society. PMID 27690412 DOI: 10.1021/Jacs.6B09464 |
0.395 |
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| 2016 |
Luo SX, Cannon JS, Taylor BL, Engle KM, Houk KN, Grubbs RH. Z-Selective Cross-Metathesis and Homodimerization of 3E-1,3-Dienes: Reaction Optimization, Computational Analysis, and Synthetic Applications. Journal of the American Chemical Society. PMID 27689541 DOI: 10.1021/Jacs.6B08387 |
0.737 |
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| 2016 |
Zargari N, Winter P, Liang Y, Lee JH, Cooksy A, Houk KN, Jung KW. An Unexpected, Latent Radical Reaction of Methane Propagated by Trifluoromethyl Radicals. The Journal of Organic Chemistry. PMID 27685006 DOI: 10.1021/Acs.Joc.6B01903 |
0.407 |
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| 2016 |
Jung ME, Sun DL, Dwight TA, Yu P, Li W, Houk KN. Synthesis of 2-Ethenylcyclopropyl Aryl Ketones via Intramolecular SN2-like Displacement of an Ester. Organic Letters. PMID 27617843 DOI: 10.1021/Acs.Orglett.6B02588 |
0.645 |
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| 2016 |
Lin B, Yu P, He CQ, Houk KN. Origins of regioselectivity in 1,3-dipolar cycloadditions of nitrile oxides with alkynylboronates. Bioorganic & Medicinal Chemistry. PMID 27501912 DOI: 10.1016/J.Bmc.2016.07.032 |
0.642 |
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| 2016 |
Li Y, Osuna S, Garcia-Borràs M, Qi X, Liu S, Houk KN, Lan Y. Reactivity of Single-Walled Carbon Nanotubes in the Diels-Alder Cycloaddition Reaction: Distortion-Interaction Analysis along the Reaction Pathway. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 27465519 DOI: 10.1002/Chem.201601799 |
0.671 |
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| 2016 |
Grayson MN, Houk KN. Cinchona Urea-Catalyzed Asymmetric Sulfa-Michael Reactions: The Brønsted Acid-Hydrogen Bonding Model. Journal of the American Chemical Society. PMID 27396591 DOI: 10.1021/jacs.6b05074 |
0.314 |
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| 2016 |
Yu P, Yang Z, Liang Y, Hong X, Li Y, Houk KN. Distortion-Controlled Reactivity and Molecular Dynamics of Dehydro-Diels-Alder Reactions. Journal of the American Chemical Society. PMID 27286801 DOI: 10.1021/Jacs.6B04113 |
0.774 |
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| 2016 |
Lee J, Grandner JM, Engle KM, Houk KN, Grubbs RH. In Situ Catalyst Modification in Atom Transfer Radical Reactions with Ruthenium Benzylidene Complexes. Journal of the American Chemical Society. 138: 7171-7. PMID 27186790 DOI: 10.1021/Jacs.6B03767 |
0.594 |
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| 2016 |
Yang YF, Houk KN, Wu YD. Computational Exploration of Rh(III)/Rh(V) and Rh(III)/Rh(I) Catalysis in Rhodium (III)-Catalyzed C-H Activation Reactions of N-Phenoxyacetamides with Alkynes. Journal of the American Chemical Society. PMID 27177448 DOI: 10.1021/Jacs.6B03424 |
0.616 |
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| 2016 |
Noey EL, Jiménez-Osés G, Clive DL, Houk KN. Computations reveal that electron-withdrawing leaving groups facilitate intramolecular conjugate displacement reactions by negative hyperconjugation. The Journal of Organic Chemistry. PMID 27100519 DOI: 10.1021/Acs.Joc.6B00691 |
0.819 |
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| 2016 |
Liu F, Yang Z, Mei Y, Houk KN. QM/QM' Direct Molecular Dynamics of Water-Accelerated Diels-Alder Reaction. The Journal of Physical Chemistry. B. PMID 27092967 DOI: 10.1021/acs.jpcb.6b02336 |
0.581 |
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| 2016 |
Park J, McDonald JJ, Petter RC, Houk KN. Molecular dynamics analysis of binding of kinase inhibitors to WT EGFR and the T790M mutant. Journal of Chemical Theory and Computation. PMID 27010480 DOI: 10.1021/Acs.Jctc.5B01221 |
0.481 |
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| 2016 |
Li X, Song W, Zhao XL, Ke X, Xu X, Liu P, Houk KN, Tang W. Rhodium-Catalyzed [5+2] Cycloaddition of Inverted 3-Acyloxy-1,4-enyne and Alkyne: Experimental and Theoretical Studies. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 26990319 DOI: 10.1002/Chem.201601195 |
0.483 |
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| 2016 |
Jiang X, O'Brien ZJ, Yang S, Lai LH, Buenaflor J, Tan C, Khan S, Houk KN, Garcia-Garibay MA. Crystal Fluidity Reflected by Fast Rotational Motion at the Core, Branches and Peripheral Aromatic Groups of a Dendrimeric Molecular Rotor. Journal of the American Chemical Society. PMID 26973017 DOI: 10.1021/Jacs.6B01398 |
0.53 |
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| 2016 |
Lam YH, Grayson MN, Holland MC, Simon A, Houk KN. Theory and Modeling of Asymmetric Catalytic Reactions. Accounts of Chemical Research. PMID 26967569 DOI: 10.1021/Acs.Accounts.6B00006 |
0.495 |
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| 2016 |
Yang Z, Yu P, Houk KN. Molecular Dynamics of Dimethyldioxirane C-H Oxidation. Journal of the American Chemical Society. PMID 26964643 DOI: 10.1021/Jacs.6B01028 |
0.751 |
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| 2016 |
Lin HC, McMahon TC, Patel A, Corsello M, Simon A, Xu W, Zhao M, Houk KN, Garg NK, Tang Y. P450-Mediated Coupling of Indole Fragments to Forge Communesin and Unnatural Isomers. Journal of the American Chemical Society. PMID 26963294 DOI: 10.1021/Jacs.6B01413 |
0.408 |
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| 2016 |
Patel A, Chen Z, Yang Z, Gutierrez O, Liu HW, Houk KN, Singleton DA. Dynamically complex [6+4] and [4+2] cycloadditions in the biosynthesis of spinosyn A. Journal of the American Chemical Society. PMID 26909570 DOI: 10.1021/Jacs.6B00017 |
0.732 |
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| 2016 |
Barber JS, Styduhar ED, Pham HV, McMahon TC, Houk KN, Garg NK. Nitrone Cycloadditions of 1,2-Cyclohexadiene. Journal of the American Chemical Society. PMID 26854652 DOI: 10.1021/Jacs.5B13304 |
0.449 |
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| 2016 |
Martinez-Solorio D, Melillo B, Sanchez L, Liang Y, Lam E, Houk KN, Smith AB. Design, Synthesis, and Validation of an Effective, Reusable Silicon-Based Transfer Agent for Room-Temperature Pd-Catalyzed Cross-Coupling Reactions of Aryl and Heteroaryl Chlorides with Readily Available Aryl Lithium Reagents. Journal of the American Chemical Society. PMID 26835838 DOI: 10.1021/Jacs.5B13260 |
0.379 |
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| 2016 |
Hie L, Fine Nathel NF, Hong X, Yang YF, Houk KN, Garg NK. Nickel-Catalyzed Activation of Acyl C-O Bonds of Methyl Esters. Angewandte Chemie (International Ed. in English). PMID 26804615 DOI: 10.1002/Anie.201511486 |
0.417 |
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| 2016 |
Yang YF, Liang Y, Liu F, Houk KN. Diels-Alder Reactivities of Benzene, Pyridine, and Di-, Tri- and Tetrazines: The Roles of Geometrical Distortions and Orbital Interactions. Journal of the American Chemical Society. PMID 26804318 DOI: 10.1021/Jacs.5B12054 |
0.36 |
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| 2016 |
Rosebrugh LE, Ahmed TS, Marx VM, Hartung J, Liu P, García López J, Houk KN, Grubbs RH. Probing Stereoselectivity in Ring-Opening Metathesis Polymerization Mediated by Cyclometalated Ruthenium-Based Catalysts: A Combined Experimental and Computational Study. Journal of the American Chemical Society. PMID 26726835 DOI: 10.1021/Jacs.5B12277 |
0.434 |
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| 2016 |
Vogel P, Lam YH, Simon A, Houk KN. Organocatalysis: Fundamentals and comparisons to metal and enzyme catalysis Catalysts. 6. DOI: 10.3390/Catal6090128 |
0.461 |
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| 2016 |
Yavuz I, Lopez SA, Lin JB, Houk KN. Quantitative prediction of morphology and electron transport in crystal and disordered organic semiconductors Journal of Materials Chemistry C. 4: 11238-11243. DOI: 10.1039/C6Tc03823A |
0.576 |
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| 2016 |
Rodríguez E, Grayson MN, Asensio A, Barrio P, Houk KN, Fustero S. Chiral Brønsted Acid-Catalyzed Asymmetric Allyl(propargyl)boration Reaction of ortho-Alkynyl Benzaldehydes: Synthetic Applications and Factors Governing the Enantioselectivity Acs Catalysis. 6: 2506-2514. DOI: 10.1021/acscatal.6b00209 |
0.311 |
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| 2016 |
Park J, McDonald JJ, Petter RC, Houk K. The Influences of Drug-Resistant Mutations of EGFR to the Inhibitor Binding Affinity and the Drug Target Selectivity Profiles Biophysical Journal. 110: 544a. DOI: 10.1016/J.Bpj.2015.11.2910 |
0.471 |
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| 2015 |
Jung ME, Roberts CA, Perez F, Pham HV, Zou L, Houk KN. Thermodynamic Control of Isomerizations of Bicyclic Radicals: Interplay of Ring Strain and Radical Stabilization. Organic Letters. PMID 26670884 DOI: 10.1021/Acs.Orglett.5B03112 |
0.507 |
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| 2015 |
Noey EL, Tibrewal N, Jiménez-Osés G, Osuna S, Park J, Bond CM, Cascio D, Liang J, Zhang X, Huisman GW, Tang Y, Houk KN. Origins of stereoselectivity in evolved ketoreductases. Proceedings of the National Academy of Sciences of the United States of America. PMID 26644568 DOI: 10.1073/Pnas.1507910112 |
0.792 |
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| 2015 |
Baxter RD, Liang Y, Hong X, Brown TA, Zare RN, Houk KN, Baran PS, Blackmond DG. Mechanistic Insights into Two-Phase Radical C-H Arylations. Acs Central Science. 1: 456-462. PMID 26640819 DOI: 10.1021/Acscentsci.5B00332 |
0.338 |
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| 2015 |
Walton MC, Yang YF, Hong X, Houk KN, Overman LE. Ligand-Controlled Diastereoselective 1,3-Dipolar Cycloadditions of Azomethine Ylides with Methacrylonitrile. Organic Letters. PMID 26605985 DOI: 10.1021/Acs.Orglett.5B03171 |
0.373 |
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| 2015 |
Yang Z, Doubleday C, Houk KN. QM/MM Protocol for Direct Molecular Dynamics of Chemical Reactions in Solution: The Water-Accelerated Diels-Alder Reaction. Journal of Chemical Theory and Computation. PMID 26588803 DOI: 10.1021/acs.jctc.5b01029 |
0.615 |
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| 2015 |
Hooper JF, James NC, Bozkurt E, Aviyente V, White JM, Holland MC, Gilmour R, Holmes AB, Houk KN. Medium ring effects on the endo/exo selectivity of the organo-catalytic intramolecular Diels-Alder reaction. The Journal of Organic Chemistry. PMID 26560246 DOI: 10.1021/Acs.Joc.5B02037 |
0.449 |
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| 2015 |
He CQ, Chen TQ, Patel A, Karabiyikoglu S, Merlic CA, Houk KN. Distortion, Tether, and Entropy Effects on Transannular Diels-Alder Cycloaddition Reactions of 10-18-Membered Rings. The Journal of Organic Chemistry. 80: 11039-47. PMID 26466172 DOI: 10.1021/Acs.Joc.5B02288 |
0.339 |
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| 2015 |
Levandowski BJ, Zou L, Houk KN. Schleyer hyperconjugative aromaticity and Diels-Alder reactivity of 5-substituted cyclopentadienes. Journal of Computational Chemistry. PMID 26444427 DOI: 10.1002/Jcc.24191 |
0.54 |
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| 2015 |
Patel A, Vella JR, Ma ZX, Hsung RP, Houk KN. Transition State Gauche Effects Control the Torquoselectivities of the Electrocyclizations of Chiral 1-Azatrienes. The Journal of Organic Chemistry. PMID 26435446 DOI: 10.1021/Acs.Joc.5B02085 |
0.377 |
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| 2015 |
Yu P, Patel A, Houk KN. A Transannular [6+4] and Ambimodal Cycloaddition in the Biosynthesis of Heronamide A. Journal of the American Chemical Society. PMID 26435377 DOI: 10.1021/Jacs.5B06656 |
0.671 |
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| 2015 |
Asari AH, Lam YH, Tius MA, Houk KN. Origins of the Stereoselectivity in a Thiourea-Primary Amine-Catalyzed Nazarov Cyclization. Journal of the American Chemical Society. PMID 26426475 DOI: 10.1021/Jacs.5B08969 |
0.397 |
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| 2015 |
Phillips EM, Mesganaw T, Patel A, Duttwyler S, Mercado BQ, Houk KN, Ellman JA. Synthesis of ent-ketorfanol via a C-H alkenylation/torquoselective 6π electrocyclization cascade. Angewandte Chemie (International Ed. in English). 54: 12044-8. PMID 26385263 DOI: 10.1002/Anie.201505604 |
0.31 |
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| 2015 |
Sato M, Yagishita F, Mino T, Uchiyama N, Patel A, Chooi YH, Goda Y, Xu W, Noguchi H, Yamamoto T, Hotta K, Houk KN, Tang Y, Watanabe K. Involvement of Lipocalin-like CghA in Decalin-Forming Stereoselective Intramolecular [4+2] Cycloaddition. Chembiochem : a European Journal of Chemical Biology. PMID 26360642 DOI: 10.1002/Cbic.201500386 |
0.502 |
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| 2015 |
Mao XM, Zhan ZJ, Grayson MN, Tang MC, Xu W, Li YQ, Yin WB, Lin HC, Chooi YH, Houk KN, Tang Y. Efficient Biosynthesis of Fungal Polyketides Containing the Dioxabicyclo-octane Ring System. Journal of the American Chemical Society. PMID 26340065 DOI: 10.1021/Jacs.5B07816 |
0.462 |
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| 2015 |
Chung TS, Lopez SA, Houk KN, Garcia-Garibay MA. Stereospecific Synthesis of Substituted Aziridines by a Crystal-to-Crystal Photodenitrogenation of Δ(2)-1,2,3-Triazolines. Organic Letters. 17: 4568-71. PMID 26338467 DOI: 10.1021/Acs.Orglett.5B02290 |
0.772 |
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| 2015 |
Honda K, Lopez SA, Houk KN, Mikami K. Mono-, Di-, and Trifluoroalkyl Substituent Effects on the Torquoselectivities of Cyclobutene and Oxetene Electrocyclic Ring Openings. The Journal of Organic Chemistry. PMID 26301819 DOI: 10.1021/Acs.Joc.5B01361 |
0.657 |
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| 2015 |
Hog DT, Huber FM, Jiménez-Osés G, Mayer P, Houk KN, Trauner D. Evolution of a Unified Strategy for Complex Sesterterpenoids: Progress toward Astellatol and the Total Synthesis of (-)-Nitidasin. Chemistry (Weinheim An Der Bergstrasse, Germany). 21: 13646-65. PMID 26300211 DOI: 10.1002/Chem.201501423 |
0.617 |
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| 2015 |
Larsen MH, Houk KN, Hashmi AS. Dual Gold Catalysis: Stepwise Catalyst Transfer via Dinuclear Clusters. Journal of the American Chemical Society. PMID 26258807 DOI: 10.1021/Jacs.5B05773 |
0.311 |
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| 2015 |
Narayan AR, Jiménez-Osés G, Liu P, Negretti S, Zhao W, Gilbert MM, Ramabhadran RO, Yang YF, Furan LR, Li Z, Podust LM, Montgomery J, Houk KN, Sherman DH. Enzymatic hydroxylation of an unactivated methylene C-H bond guided by molecular dynamics simulations. Nature Chemistry. 7: 653-60. PMID 26201742 DOI: 10.1038/Nchem.2285 |
0.666 |
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| 2015 |
Hie L, Fine Nathel NF, Shah TK, Baker EL, Hong X, Yang YF, Liu P, Houk KN, Garg NK. Conversion of amides to esters by the nickel-catalysed activation of amide C-N bonds. Nature. PMID 26200342 DOI: 10.1038/Nature14615 |
0.512 |
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| 2015 |
Camelio AM, Liang Y, Eliasen AM, Johnson TC, Yuan C, Schuppe AW, Houk KN, Siegel D. Computational and Experimental Studies of Phthaloyl Peroxide-Mediated Hydroxylation of Arenes Yield a More Reactive Derivative, 4,5-Dichlorophthaloyl Peroxide. The Journal of Organic Chemistry. 80: 8084-95. PMID 26200205 DOI: 10.1021/Acs.Joc.5B01079 |
0.44 |
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| 2015 |
Neufeldt SR, Jiménez-Osés G, Huckins JR, Thiel OR, Houk KN. Pyridine N-Oxide vs Pyridine Substrates for Rh(III)-Catalyzed Oxidative C-H Bond Functionalization. Journal of the American Chemical Society. 137: 9843-54. PMID 26197041 DOI: 10.1021/Jacs.5B03535 |
0.793 |
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| 2015 |
Hong X, Bercovici DA, Yang Z, Al-Bataineh N, Srinivasan R, Dhakal RC, Houk KN, Brewer M. Mechanism and Dynamics of Intramolecular C-H Insertion Reactions of 1-Aza-2-azoniaallene Salts. Journal of the American Chemical Society. 137: 9100-7. PMID 26151292 DOI: 10.1021/Jacs.5B04474 |
0.655 |
|
| 2015 |
Grayson MN, Krische MJ, Houk KN. Ruthenium-Catalyzed Asymmetric Hydrohydroxyalkylation of Butadiene: The Role of the Formyl Hydrogen Bond in Stereochemical Control. Journal of the American Chemical Society. PMID 26107070 DOI: 10.1021/Jacs.5B04844 |
0.386 |
|
| 2015 |
Kamber DN, Liang Y, Blizzard RJ, Liu F, Mehl RA, Houk KN, Prescher JA. 1,2,4-Triazines Are Versatile Bioorthogonal Reagents. Journal of the American Chemical Society. PMID 26084312 DOI: 10.1021/Jacs.5B05100 |
0.346 |
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| 2015 |
Pham HV, Karns AS, Vanderwal CD, Houk KN. Computational and experimental investigations of the formal dyotropic rearrangements of himbert arene/allene cycloadducts. Journal of the American Chemical Society. 137: 6956-64. PMID 25961134 DOI: 10.1021/Jacs.5B03718 |
0.41 |
|
| 2015 |
Krenske EH, Lam S, Ng JP, Lo B, Lam SK, Chiu P, Houk KN. Concerted Ring Opening and Cycloaddition of Chiral Epoxy Enolsilanes with Dienes. Angewandte Chemie (International Ed. in English). 54: 7422-5. PMID 25951012 DOI: 10.1002/Anie.201503003 |
0.69 |
|
| 2015 |
Engle KM, Lu G, Luo SX, Henling LM, Takase MK, Liu P, Houk KN, Grubbs RH. Origins of initiation rate differences in ruthenium olefin metathesis catalysts containing chelating benzylidenes. Journal of the American Chemical Society. 137: 5782-92. PMID 25897653 DOI: 10.1021/Jacs.5B01144 |
0.691 |
|
| 2015 |
Wang XN, Krenske EH, Johnston RC, Houk KN, Hsung RP. AlCl₃-Catalyzed Ring Expansion Cascades of Bicyclic Cyclobutenamides Involving Highly Strained Cis,Trans-Cycloheptadienone Intermediates. Journal of the American Chemical Society. 137: 5596-601. PMID 25895058 DOI: 10.1021/Jacs.5B02561 |
0.809 |
|
| 2015 |
Ma ZX, Patel A, Houk KN, Hsung RP. Highly torquoselective electrocyclizations and competing 1,7-hydrogen shifts of 1-azatrienes with silyl substitution at the allylic carbon. Organic Letters. 17: 2138-41. PMID 25859907 DOI: 10.1021/Acs.Orglett.5B00727 |
0.37 |
|
| 2015 |
McMahon TC, Medina JM, Yang YF, Simmons BJ, Houk KN, Garg NK. Generation and regioselective trapping of a 3,4-piperidyne for the synthesis of functionalized heterocycles. Journal of the American Chemical Society. 137: 4082-5. PMID 25768436 DOI: 10.1021/Jacs.5B01589 |
0.35 |
|
| 2015 |
Levandowski BJ, Houk KN. Theoretical analysis of reactivity patterns in Diels-Alder reactions of cyclopentadiene, cyclohexadiene, and cycloheptadiene with symmetrical and unsymmetrical dienophiles. The Journal of Organic Chemistry. 80: 3530-7. PMID 25741891 DOI: 10.1021/acs.joc.5b00174 |
0.331 |
|
| 2015 |
Osuna S, Jiménez-Osés G, Noey EL, Houk KN. Molecular dynamics explorations of active site structure in designed and evolved enzymes. Accounts of Chemical Research. 48: 1080-9. PMID 25738880 DOI: 10.1021/Ar500452Q |
0.785 |
|
| 2015 |
Boeser CL, Holder JC, Taylor BL, Houk KN, Stoltz BM, Zare RN. Mechanistic analysis of an asymmetric palladium-catalyzed conjugate addition of arylboronic acids to β-substituted cyclic enones. Chemical Science (Royal Society of Chemistry : 2010). 6: 1917-1922. PMID 25729560 DOI: 10.1039/C4Sc03337J |
0.637 |
|
| 2015 |
Törk L, Jiménez-Osés G, Doubleday C, Liu F, Houk KN. Molecular dynamics of the Diels-Alder reactions of tetrazines with alkenes and N2 extrusions from adducts. Journal of the American Chemical Society. 137: 4749-58. PMID 25726899 DOI: 10.1021/Jacs.5B00014 |
0.613 |
|
| 2015 |
Numajiri Y, Jiménez-Osés G, Wang B, Houk KN, Stoltz BM. Enantioselective synthesis of dialkylated N-heterocycles by palladium-catalyzed allylic alkylation. Organic Letters. 17: 1082-5. PMID 25714704 DOI: 10.1021/Ol503425T |
0.604 |
|
| 2015 |
Yavuz I, Martin BN, Park J, Houk KN. Theoretical study of the molecular ordering, paracrystallinity, and charge mobilities of oligomers in different crystalline phases. Journal of the American Chemical Society. 137: 2856-66. PMID 25658235 DOI: 10.1021/Ja5076376 |
0.486 |
|
| 2015 |
Pérez-Estrada S, Rodríguez-Molina B, Xiao L, Santillan R, Jiménez-Osés G, Houk KN, Garcia-Garibay MA. Thermodynamic evaluation of aromatic CH/π interactions and rotational entropy in a molecular rotor. Journal of the American Chemical Society. 137: 2175-8. PMID 25635355 DOI: 10.1021/Ja512053T |
0.7 |
|
| 2015 |
Lam YH, Houk KN. Origins of stereoselectivity in intramolecular aldol reactions catalyzed by cinchona amines. Journal of the American Chemical Society. 137: 2116-27. PMID 25629689 DOI: 10.1021/ja513096x |
0.366 |
|
| 2015 |
Zheng Y, Miao MS, Dantelle G, Eisenmenger ND, Wu G, Yavuz I, Chabinyc ML, Houk KN, Wudl F. A solid-state effect responsible for an organic quintet state at room temperature and ambient pressure. Advanced Materials (Deerfield Beach, Fla.). 27: 1718-23. PMID 25619560 DOI: 10.1002/Adma.201405093 |
0.376 |
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| 2015 |
Xie S, Lopez SA, Ramström O, Yan M, Houk KN. 1,3-Dipolar cycloaddition reactivities of perfluorinated aryl azides with enamines and strained dipolarophiles. Journal of the American Chemical Society. 137: 2958-66. PMID 25553488 DOI: 10.1021/Ja511457G |
0.69 |
|
| 2015 |
Park J, Pham HV, Mogensen K, Solling TI, Bennetzen MV, Houk KN. Hydrocarbon binding by proteins: structures of protein binding sites for ≥C10 linear alkanes or long-chain alkyl and alkenyl groups. The Journal of Organic Chemistry. 80: 997-1005. PMID 25526284 DOI: 10.1021/Jo502488E |
0.557 |
|
| 2015 |
Krenske EH, Houk KN, Harmata M. Computational analysis of the stereochemical outcome in the imidazolidinone-catalyzed enantioselective (4 + 3)-cycloaddition reaction. The Journal of Organic Chemistry. 80: 744-50. PMID 25525966 DOI: 10.1021/Jo501906M |
0.664 |
|
| 2015 |
Tang W, Jiménez-Osés G, Houk KN, van der Donk WA. Substrate control in stereoselective lanthionine biosynthesis. Nature Chemistry. 7: 57-64. PMID 25515891 DOI: 10.1038/Nchem.2113 |
0.602 |
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| 2015 |
Richmond E, Ling KB, Duguet N, Manton LB, Çelebi-Ölçüm N, Lam YH, Alsancak S, Slawin AM, Houk KN, Smith AD. An asymmetric pericyclic cascade approach to 3-alkyl-3-aryloxindoles: generality, applications and mechanistic investigations. Organic & Biomolecular Chemistry. 13: 1807-17. PMID 25501712 DOI: 10.1039/C4Ob02526A |
0.365 |
|
| 2015 |
Denmark SE, Chang WT, Houk KN, Liu P. Development of Chiral Bis-hydrazone Ligands for the Enantioselective Cross-Coupling Reactions of Aryldimethylsilanolates. The Journal of Organic Chemistry. 80: 313-66. PMID 25494058 DOI: 10.1021/Jo502388R |
0.432 |
|
| 2015 |
Zhang L, Cao Y, Colella NS, Liang Y, Brédas JL, Houk KN, Briseno AL. Unconventional, chemically stable, and soluble two-dimensional angular polycyclic aromatic hydrocarbons: from molecular design to device applications. Accounts of Chemical Research. 48: 500-9. PMID 25458442 DOI: 10.1021/Ar500278W |
0.36 |
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| 2015 |
Wang H, Hsieh B, Jiménez-Osés G, Liu P, Tassone CJ, Diao Y, Lei T, Houk KN, Bao Z. Solvent effects on polymer sorting of carbon nanotubes with applications in printed electronics. Small (Weinheim An Der Bergstrasse, Germany). 11: 126-33. PMID 25138541 DOI: 10.1002/Smll.201401890 |
0.611 |
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| 2015 |
Molnár IG, Holland MC, Daniliuc C, Houk KN, Gilmour R. Organocatalysis Intermediates as Platforms to Study Noncovalent Interactions: Integrating Fluorine Gauche Effects in Iminium Systems to Facilitate Acyclic Conformational Control Synlett. DOI: 10.1055/S-0035-1561199 |
0.346 |
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| 2015 |
Thiehoff C, Holland MC, Daniliuc C, Houk KN, Gilmour R. Can acyclic conformational control be achieved via a sulfur-fluorine gauche effect? Chemical Science. 6: 3565-3571. DOI: 10.1039/C5Sc00871A |
0.336 |
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| 2015 |
Hong X, Bercovici DA, Yang Z, Al-Bataineh N, Srinivasan R, Dhakal RC, Houk KN, Brewer M. Mechanism and Dynamics of Intramolecular C-H Insertion Reactions of 1-Aza-2-azoniaallene Salts Journal of the American Chemical Society. 137: 9100-9107. DOI: 10.1021/jacs.5b04474 |
0.612 |
|
| 2015 |
Herbert MB, Suslick BA, Liu P, Zou L, Dornan PK, Houk KN, Grubbs RH. Cyclometalated Z-Selective Ruthenium Metathesis Catalysts with Modified N-Chelating Groups Organometallics. 34: 2858-2869. DOI: 10.1021/Acs.Organomet.5B00185 |
0.569 |
|
| 2015 |
Camelio AM, Liang Y, Eliasen AM, Johnson TC, Yuan C, Schuppe AW, Houk KN, Siegel D. Computational and Experimental Studies of Phthaloyl Peroxide-Mediated Hydroxylation of Arenes Yield a More Reactive Derivative, 4,5-Dichlorophthaloyl Peroxide Journal of Organic Chemistry. 80: 8084-8095. DOI: 10.1021/acs.joc.5b01079 |
0.328 |
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| 2015 |
Wang X, Krenske EH, Johnston RC, Houk KN, Hsung RP. ChemInform Abstract: AlCl3-Catalyzed Ring Expansion Cascades of Bicyclic Cyclobutenamides Involving Highly Strained cis,trans-Cycloheptadienone Intermediates. Cheminform. 46: no-no. DOI: 10.1002/chin.201538074 |
0.792 |
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| 2015 |
Merrer DC, Houk KN, Xu L. ChemInform Abstract: Dynamics in Carbene Reactions Cheminform. 46: no-no. DOI: 10.1002/chin.201508345 |
0.475 |
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| 2015 |
Wang H, Li Y, Jiménez-Osés G, Liu P, Fang Y, Zhang J, Lai YC, Park S, Chen L, Houk KN, Bao Z. N-type conjugated polymer-enabled selective dispersion of semiconducting carbon nanotubes for flexible CMOS-like circuits Advanced Functional Materials. 25: 1837-1844. DOI: 10.1002/Adfm.201404126 |
0.59 |
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| 2014 |
Malik HA, Taylor BL, Kerrigan JR, Grob JE, Houk KN, Du Bois J, Hamann LG, Patterson AW. Non-Directed Allylic C-H Acetoxylation in the Presence of Lewis Basic Heterocycles. Chemical Science (Royal Society of Chemistry : 2010). 5: 2352-2361. PMID 25685311 DOI: 10.1039/C3Sc53414F |
0.588 |
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| 2014 |
Kumar P, Thakur A, Hong X, Houk KN, Louie J. Ni(NHC)]-catalyzed cycloaddition of diynes and tropone: apparent enone cycloaddition involving an 8π insertion. Journal of the American Chemical Society. 136: 17844-51. PMID 25416006 DOI: 10.1021/Ja5105206 |
0.341 |
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| 2014 |
Haynes MT, Liu P, Baxter RD, Nett AJ, Houk KN, Montgomery J. Dimer involvement and origin of crossover in nickel-catalyzed aldehyde-alkyne reductive couplings. Journal of the American Chemical Society. 136: 17495-504. PMID 25401337 DOI: 10.1021/Ja508909U |
0.463 |
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| 2014 |
Hong X, Stevens MC, Liu P, Wender PA, Houk KN. Reactivity and chemoselectivity of allenes in Rh(I)-catalyzed intermolecular (5 + 2) cycloadditions with vinylcyclopropanes: allene-mediated rhodacycle formation can poison Rh(I)-catalyzed cycloadditions. Journal of the American Chemical Society. 136: 17273-83. PMID 25379606 DOI: 10.1021/Ja5098308 |
0.496 |
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| 2014 |
Neufeldt SR, Jiménez-Osés G, Comins DL, Houk KN. A twist on facial selectivity of hydride reductions of cyclic ketones: twist-boat conformers in cyclohexanone, piperidone, and tropinone reactions. The Journal of Organic Chemistry. 79: 11609-18. PMID 25372509 DOI: 10.1021/Jo5022635 |
0.768 |
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| 2014 |
Patel A, Houk KN. Terminal substituent effects on the reactivity, thermodynamics, and stereoselectivity of the 8π-6π electrocyclization cascades of 1,3,5,7-tetraenes. The Journal of Organic Chemistry. 79: 11370-7. PMID 25358094 DOI: 10.1021/jo5015728 |
0.325 |
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| 2014 |
Liang Y, Hong X, Yu P, Houk KN. Why alkynyl substituents dramatically accelerate hexadehydro-Diels-Alder (HDDA) reactions: stepwise mechanisms of HDDA cycloadditions. Organic Letters. 16: 5702-5. PMID 25329369 DOI: 10.1021/Ol502780W |
0.691 |
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| 2014 |
Hong X, Holte D, Götz DC, Baran PS, Houk KN. Mechanism, reactivity, and selectivity of nickel-catalyzed [4 + 4 + 2] cycloadditions of dienes and alkynes. The Journal of Organic Chemistry. 79: 12177-84. PMID 25325891 DOI: 10.1021/Jo502219D |
0.371 |
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| 2014 |
Yang Z, Jiménez-Osés G, López CJ, Bridges MD, Houk KN, Hubbell WL. Long-range distance measurements in proteins at physiological temperatures using saturation recovery EPR spectroscopy. Journal of the American Chemical Society. 136: 15356-65. PMID 25290172 DOI: 10.1021/Ja5083206 |
0.682 |
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| 2014 |
Medina JM, McMahon TC, Jiménez-Osés G, Houk KN, Garg NK. Cycloadditions of cyclohexynes and cyclopentyne. Journal of the American Chemical Society. 136: 14706-9. PMID 25283710 DOI: 10.1021/Ja508635V |
0.528 |
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| 2014 |
Michaudel Q, Journot G, Regueiro-Ren A, Goswami A, Guo Z, Tully TP, Zou L, Ramabhadran RO, Houk KN, Baran PS. Improving physical properties via C-H oxidation: chemical and enzymatic approaches. Angewandte Chemie (International Ed. in English). 53: 12091-6. PMID 25244630 DOI: 10.1002/Anie.201407016 |
0.501 |
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| 2014 |
Matute RA, Garcia-Garibay MA, Houk KN. Theory of substituent effects on the regioselectivity of di-π-methane rearrangements of dibenzobarrelenes. Organic Letters. 16: 5232-4. PMID 25237757 DOI: 10.1021/Ol5024823 |
0.793 |
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| 2014 |
Pham HV, Houk KN. Diels-Alder reactions of allene with benzene and butadiene: concerted, stepwise, and ambimodal transition states. The Journal of Organic Chemistry. 79: 8968-76. PMID 25216056 DOI: 10.1021/Jo502041F |
0.432 |
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| 2014 |
Yang YF, Chung LW, Zhang X, Houk KN, Wu YD. Ligand-controlled reactivity, selectivity, and mechanism of cationic ruthenium-catalyzed hydrosilylations of alkynes, ketones, and nitriles: a theoretical study. The Journal of Organic Chemistry. 79: 8856-64. PMID 25157438 DOI: 10.1021/Jo501730N |
0.71 |
|
| 2014 |
Meng SS, Liang Y, Cao KS, Zou L, Lin XB, Yang H, Houk KN, Zheng WH. Chiral phosphoric acid catalyzed highly enantioselective desymmetrization of 2-substituted and 2,2-disubstituted 1,3-diols via oxidative cleavage of benzylidene acetals. Journal of the American Chemical Society. 136: 12249-52. PMID 25126836 DOI: 10.1021/Ja507332X |
0.586 |
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| 2014 |
Lopez SA, Pourati M, Gais HJ, Houk KN. How torsional effects cause attack at sterically crowded concave faces of bicyclic alkenes. The Journal of Organic Chemistry. 79: 8304-12. PMID 25068678 DOI: 10.1021/Jo501557Z |
0.685 |
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| 2014 |
Hong X, Liang Y, Brewer M, Houk KN. How tethers control the chemo- and regioselectivities of intramolecular cycloadditions between aryl-1-aza-2-azoniaallenes and alkenes. Organic Letters. 16: 4260-3. PMID 25058856 DOI: 10.1021/Ol501958S |
0.41 |
|
| 2014 |
Liu F, Liang Y, Houk KN. Theoretical elucidation of the origins of substituent and strain effects on the rates of Diels-Alder reactions of 1,2,4,5-tetrazines. Journal of the American Chemical Society. 136: 11483-93. PMID 25041719 DOI: 10.1021/Ja505569A |
0.489 |
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| 2014 |
Han X, Bian S, Liang Y, Houk KN, Braunschweig AB. Reactions in elastomeric nanoreactors reveal the role of force on the kinetics of the Huisgen reaction on surfaces. Journal of the American Chemical Society. 136: 10553-6. PMID 25028773 DOI: 10.1021/Ja504137U |
0.337 |
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| 2014 |
Cao Y, Liang Y, Zhang L, Osuna S, Hoyt AL, Briseno AL, Houk KN. Why bistetracenes are much less reactive than pentacenes in Diels-Alder reactions with fullerenes. Journal of the American Chemical Society. 136: 10743-51. PMID 25007333 DOI: 10.1021/Ja505240E |
0.424 |
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| 2014 |
Wang XN, Krenske EH, Johnston RC, Houk KN, Hsung RP. Torquoselective ring opening of fused cyclobutenamides: evidence for a cis,trans-cyclooctadienone intermediate. Journal of the American Chemical Society. 136: 9802-5. PMID 24992255 DOI: 10.1021/Ja502252T |
0.791 |
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| 2014 |
Wang H, Koleilat GI, Liu P, Jiménez-Osés G, Lai YC, Vosgueritchian M, Fang Y, Park S, Houk KN, Bao Z. Correction to High-Yield Sorting of Small-Diameter Carbon Nanotubes for Solar Cells and Transistors. Acs Nano. PMID 24988472 DOI: 10.1021/Nn503452B |
0.58 |
|
| 2014 |
Lam YH, Houk KN. How cinchona alkaloid-derived primary amines control asymmetric electrophilic fluorination of cyclic ketones. Journal of the American Chemical Society. 136: 9556-9. PMID 24967514 DOI: 10.1021/Ja504714M |
0.383 |
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| 2014 |
Jarvis CL, Richers MT, Breugst M, Houk KN, Seidel D. Redox-neutral α-sulfenylation of secondary amines: ring-fused N,S-acetals. Organic Letters. 16: 3556-9. PMID 24927364 DOI: 10.1021/Ol501509B |
0.374 |
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| 2014 |
Breugst M, Houk KN. Computational analysis of cyclophane-based bisthiourea-catalyzed Henry reactions. The Journal of Organic Chemistry. 79: 6302-9. PMID 24927014 DOI: 10.1021/Jo501227M |
0.437 |
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| 2014 |
Lopez SA, Houk KN. Substituent effects on rates and torquoselectivities of electrocyclic ring-openings of N-substituted 2-azetines. The Journal of Organic Chemistry. 79: 6189-95. PMID 24885772 DOI: 10.1021/Jo500919S |
0.703 |
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| 2014 |
Tran AT, Liu P, Houk KN, Nicholas KM. Regioselectivity in the Cu(I)-catalyzed [4 + 2]-cycloaddition of 2-nitrosopyridine with unsymmetrical dienes. The Journal of Organic Chemistry. 79: 5617-26. PMID 24853468 DOI: 10.1021/Jo5005907 |
0.507 |
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| 2014 |
Hu Y, Dietrich D, Xu W, Patel A, Thuss JA, Wang J, Yin WB, Qiao K, Houk KN, Vederas JC, Tang Y. A carbonate-forming Baeyer-Villiger monooxygenase. Nature Chemical Biology. 10: 552-4. PMID 24838010 DOI: 10.1038/Nchembio.1527 |
0.406 |
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| 2014 |
Zhu J, Liang Y, Wang L, Zheng ZB, Houk KN, Tang Y. Remote ester groups switch selectivity: diastereodivergent synthesis of tetracyclic spiroindolines. Journal of the American Chemical Society. 136: 6900-3. PMID 24766366 DOI: 10.1021/Ja503117Q |
0.39 |
|
| 2014 |
Dugas GJ, Lam YH, Houk KN, Krauss IJ. Boron carboxylate catalysis of homoallylboration. The Journal of Organic Chemistry. 79: 4277-84. PMID 24754566 DOI: 10.1021/Jo500599H |
0.382 |
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| 2014 |
Cannon JS, Zou L, Liu P, Lan Y, O'Leary DJ, Houk KN, Grubbs RH. Carboxylate-assisted C(sp³)-H activation in olefin metathesis-relevant ruthenium complexes. Journal of the American Chemical Society. 136: 6733-43. PMID 24731019 DOI: 10.1021/Ja5021958 |
0.569 |
|
| 2014 |
Jiménez-Osés G, Osuna S, Gao X, Sawaya MR, Gilson L, Collier SJ, Huisman GW, Yeates TO, Tang Y, Houk KN. The role of distant mutations and allosteric regulation on LovD active site dynamics. Nature Chemical Biology. 10: 431-6. PMID 24727900 DOI: 10.1038/Nchembio.1503 |
0.62 |
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| 2014 |
Jung ME, Lee GS, Pham HV, Houk KN. Palladium hydride promoted stereoselective isomerization of unactivated di(exo)methylenes to endocyclic dienes. Organic Letters. 16: 2382-5. PMID 24720691 DOI: 10.1021/Ol500710V |
0.352 |
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| 2014 |
Richers MT, Breugst M, Platonova AY, Ullrich A, Dieckmann A, Houk KN, Seidel D. Redox-neutral α-oxygenation of amines: reaction development and elucidation of the mechanism. Journal of the American Chemical Society. 136: 6123-35. PMID 24689802 DOI: 10.1021/Ja501988B |
0.412 |
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| 2014 |
Choi SR, Breugst M, Houk KN, Poulter CD. δ-Deuterium isotope effects as probes for transition-state structures of isoprenoid substrates. The Journal of Organic Chemistry. 79: 3572-80. PMID 24665882 DOI: 10.1021/Jo500394U |
0.445 |
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| 2014 |
Jiménez-Osés G, Liu P, Matute RA, Houk KN. Competition between concerted and stepwise dynamics in the triplet di-π-methane rearrangement. Angewandte Chemie (International Ed. in English). 53: 8664-7. PMID 24616069 DOI: 10.1002/Anie.201310237 |
0.819 |
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| 2014 |
Yang J, Liang Y, Še?kut? J, Houk KN, Devaraj NK. Synthesis and reactivity comparisons of 1-methyl-3-substituted cyclopropene mini-tags for tetrazine bioorthogonal reactions. Chemistry (Weinheim An Der Bergstrasse, Germany). 20: 3365-75. PMID 24615990 DOI: 10.1002/Chem.201304225 |
0.435 |
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| 2014 |
Green AG, Liu P, Merlic CA, Houk KN. Distortion/Interaction analysis reveals the origins of selectivities in iridium-catalyzed C-H borylation of substituted arenes and 5-membered heterocycles. Journal of the American Chemical Society. 136: 4575-83. PMID 24580415 DOI: 10.1021/Ja411699U |
0.539 |
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| 2014 |
Wang H, Koleilat GI, Liu P, Jiménez-Osés G, Lai YC, Vosgueritchian M, Fang Y, Park S, Houk KN, Bao Z. High-yield sorting of small-diameter carbon nanotubes for solar cells and transistors. Acs Nano. 8: 2609-17. PMID 24484388 DOI: 10.1021/Nn406256Y |
0.599 |
|
| 2014 |
Parker MF, Osuna S, Bollot G, Vaddypally S, Zdilla MJ, Houk KN, Schafmeister CE. Acceleration of an aromatic Claisen rearrangement via a designed spiroligozyme catalyst that mimics the ketosteroid isomerase catalytic dyad. Journal of the American Chemical Society. 136: 3817-27. PMID 24456160 DOI: 10.1021/Ja409214C |
0.367 |
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| 2014 |
Cheng GJ, Yang YF, Liu P, Chen P, Sun TY, Li G, Zhang X, Houk KN, Yu JQ, Wu YD. Role of N-acyl amino acid ligands in Pd(II)-catalyzed remote C-H activation of tethered arenes. Journal of the American Chemical Society. 136: 894-7. PMID 24410499 DOI: 10.1021/Ja411683N |
0.737 |
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| 2014 |
Pham HV, Paton RS, Ross AG, Danishefsky SJ, Houk KN. Intramolecular Diels-Alder reactions of cycloalkenones: stereoselectivity, Lewis acid acceleration, and halogen substituent effects. Journal of the American Chemical Society. 136: 2397-403. PMID 24410341 DOI: 10.1021/Ja410220W |
0.648 |
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| 2014 |
Wang H, Houk KN. Torsional Control of Stereoselectivities in Electrophilic Additions and Cycloadditions to Alkenes. Chemical Science (Royal Society of Chemistry : 2010). 5. PMID 24409340 DOI: 10.1039/C3Sc52538D |
0.404 |
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| 2014 |
Dornan PK, Kou KG, Houk KN, Dong VM. Dynamic kinetic resolution of allylic sulfoxides by Rh-catalyzed hydrogenation: a combined theoretical and experimental mechanistic study. Journal of the American Chemical Society. 136: 291-8. PMID 24350903 DOI: 10.1021/Ja409824B |
0.361 |
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| 2014 |
Yang YF, Cheng GJ, Liu P, Leow D, Sun TY, Chen P, Zhang X, Yu JQ, Wu YD, Houk KN. Palladium-catalyzed meta-selective C-H bond activation with a nitrile-containing template: computational study on mechanism and origins of selectivity. Journal of the American Chemical Society. 136: 344-55. PMID 24313742 DOI: 10.1021/Ja410485G |
0.751 |
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| 2014 |
Avery Sader C, Houk KN. Distortion/interaction analysis of the reactivities and selectivities of halo- and methoxy-substituted carbenes with alkenes Arkivoc. 2014: 170-183. DOI: 10.3998/Ark.5550190.P008.408 |
0.39 |
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| 2014 |
Houk KN, Liu P. Using Computational Chemistry to Understand & Discover Chemical Reactions Daedalus. 143: 49-66. DOI: 10.1162/Daed_A_00305 |
0.466 |
|
| 2014 |
Hong X, Liang Y, Griffith AK, Lambert TH, Houk KN. Distortion-accelerated cycloadditions and strain-release-promoted cycloreversions in the organocatalytic carbonyl-olefin metathesis Chemical Science. 5: 471-475. DOI: 10.1039/C3Sc52882K |
0.335 |
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| 2014 |
Chun S, Park J, Thompson MC, Eun C, McCammon JA, Houk KN, Yeates TO. Exploring Dynamic Events of Bacterial Microcompartment Shell Pores Biophysical Journal. 106: 803a. DOI: 10.1016/J.Bpj.2013.11.4400 |
0.562 |
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| 2013 |
Osuna S, Kim S, Bollot G, Houk KN. Aromatic Claisen Rearrangements of O-prenylated tyrosine and model prenyl aryl ethers: Computational study of the role of water on acceleration of Claisen rearrangements. European Journal of Organic Chemistry. 2013. PMID 24376368 DOI: 10.1002/Ejoc.201201738 |
0.378 |
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| 2013 |
Deng Q, Thomas BE, Houk KN, Dowd P. Transition structures of the ene reactions of cyclopropene. Journal of the American Chemical Society. 119: 6902-8. PMID 24236571 DOI: 10.1021/Ja963248Q |
0.634 |
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| 2013 |
Schwarzwalder GM, Steinhardt SE, Pham HV, Houk KN, Vanderwal CD. Synthesis of the tetracyclic core of exiguaquinol. Organic Letters. 15: 6014-7. PMID 24219829 DOI: 10.1021/Ol402905N |
0.418 |
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| 2013 |
Krenske EH, Patel A, Houk KN. Does nature click? Theoretical prediction of an enzyme-catalyzed transannular 1,3-dipolar cycloaddition in the biosynthesis of lycojaponicumins A and B. Journal of the American Chemical Society. 135: 17638-42. PMID 24195703 DOI: 10.1021/Ja409928Z |
0.664 |
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| 2013 |
Cao Y, Osuna S, Liang Y, Haddon RC, Houk KN. Diels-Alder reactions of graphene: computational predictions of products and sites of reaction. Journal of the American Chemical Society. 135: 17643-9. PMID 24159929 DOI: 10.1021/Ja410225U |
0.376 |
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| 2013 |
Morin MS, St-Cyr DJ, Arndtsen BA, Krenske EH, Houk KN. Modular mesoionics: understanding and controlling regioselectivity in 1,3-dipolar cycloadditions of Münchnone derivatives. Journal of the American Chemical Society. 135: 17349-58. PMID 24134494 DOI: 10.1021/Ja406833Q |
0.661 |
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| 2013 |
de Loera D, Liu F, Houk KN, Garcia-Garibay MA. Aziridine nitrogen inversion by dynamic NMR: activation parameters in a fused bicyclic structure. The Journal of Organic Chemistry. 78: 11623-6. PMID 24125572 DOI: 10.1021/Jo4022315 |
0.621 |
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| 2013 |
Zhang S, Çelebi-Ölçüm N, Melzer MM, Houk KN, Warren TH. Copper(I) nitrosyls from reaction of copper(II) thiolates with S-nitrosothiols: mechanism of NO release from RSNOs at Cu. Journal of the American Chemical Society. 135: 16746-9. PMID 24111922 DOI: 10.1021/Ja406476Y |
0.347 |
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| 2013 |
Lam JK, Pham HV, Houk KN, Vanderwal CD. Computation and experiment reveal that the ring-rearrangement metathesis of Himbert cycloadducts can be subject to kinetic or thermodynamic control. Journal of the American Chemical Society. 135: 17585-94. PMID 24111571 DOI: 10.1021/Ja409618P |
0.414 |
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| 2013 |
Liu F, Paton RS, Kim S, Liang Y, Houk KN. Diels-Alder reactivities of strained and unstrained cycloalkenes with normal and inverse-electron-demand dienes: activation barriers and distortion/interaction analysis. Journal of the American Chemical Society. 135: 15642-9. PMID 24044412 DOI: 10.1021/Ja408437U |
0.605 |
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| 2013 |
Osuna S, Dermenci A, Miller SJ, Houk KN. The roles of counterion and water in a stereoselective cysteine-catalyzed Rauhut-Currier reaction: a challenge for computational chemistry. Chemistry (Weinheim An Der Bergstrasse, Germany). 19: 14245-53. PMID 24038400 DOI: 10.1002/Chem.201300745 |
0.422 |
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| 2013 |
Holder JC, Zou L, Marziale AN, Liu P, Lan Y, Gatti M, Kikushima K, Houk KN, Stoltz BM. Mechanism and enantioselectivity in palladium-catalyzed conjugate addition of arylboronic acids to β-substituted cyclic enones: insights from computation and experiment. Journal of the American Chemical Society. 135: 14996-5007. PMID 24028424 DOI: 10.1021/Ja401713G |
0.622 |
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| 2013 |
Kamber DN, Nazarova LA, Liang Y, Lopez SA, Patterson DM, Shih HW, Houk KN, Prescher JA. Isomeric cyclopropenes exhibit unique bioorthogonal reactivities. Journal of the American Chemical Society. 135: 13680-3. PMID 24000889 DOI: 10.1021/Ja407737D |
0.697 |
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| 2013 |
Breugst M, Grée R, Houk KN. Synergistic effects between Lewis and Brønsted acids: application to the Prins cyclization. The Journal of Organic Chemistry. 78: 9892-7. PMID 23984760 DOI: 10.1021/Jo401628E |
0.316 |
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| 2013 |
Gao X, Jiang W, Jiménez-Osés G, Choi MS, Houk KN, Tang Y, Walsh CT. An iterative, bimodular nonribosomal peptide synthetase that converts anthranilate and tryptophan into tetracyclic asperlicins. Chemistry & Biology. 20: 870-8. PMID 23890005 DOI: 10.1016/J.Chembiol.2013.04.019 |
0.644 |
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| 2013 |
Yuan C, Liang Y, Hernandez T, Berriochoa A, Houk KN, Siegel D. Metal-free oxidation of aromatic carbon-hydrogen bonds through a reverse-rebound mechanism. Nature. 499: 192-6. PMID 23846658 DOI: 10.1038/Nature12284 |
0.405 |
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| 2013 |
Souris C, Frébault F, Patel A, Audisio D, Houk KN, Maulide N. Stereoselective synthesis of dienyl-carboxylate building blocks: formal synthesis of inthomycin C. Organic Letters. 15: 3242-5. PMID 23763296 DOI: 10.1021/Ol401226Y |
0.304 |
|
| 2013 |
James NC, Um JM, Padias AB, Hall HK, Houk KN. Computational investigation of the competition between the concerted Diels-Alder reaction and formation of diradicals in reactions of acrylonitrile with nonpolar dienes. The Journal of Organic Chemistry. 78: 6582-92. PMID 23758325 DOI: 10.1021/Jo400900X |
0.777 |
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| 2013 |
Xu X, Liu P, Shu XZ, Tang W, Houk KN. Rh-catalyzed (5+2) cycloadditions of 3-acyloxy-1,4-enynes and alkynes: computational study of mechanism, reactivity, and regioselectivity. Journal of the American Chemical Society. 135: 9271-4. PMID 23725341 DOI: 10.1021/Ja4036785 |
0.537 |
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| 2013 |
Mejuch T, Gilboa N, Gayon E, Wang H, Houk KN, Marek I. Axial preferences in allylation reactions via the Zimmerman-Traxler transition state. Accounts of Chemical Research. 46: 1659-69. PMID 23672428 DOI: 10.1021/Ar4000532 |
0.442 |
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| 2013 |
Schmidt Y, Lam JK, Pham HV, Houk KN, Vanderwal CD. Studies on the Himbert intramolecular arene/allene Diels-Alder cycloaddition. Mechanistic studies and expansion of scope to all-carbon tethers. Journal of the American Chemical Society. 135: 7339-48. PMID 23634642 DOI: 10.1021/Ja4025963 |
0.435 |
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| 2013 |
Hong X, Trost BM, Houk KN. Mechanism and origins of selectivity in Ru(II)-catalyzed intramolecular (5+2) cycloadditions and ene reactions of vinylcyclopropanes and alkynes from density functional theory. Journal of the American Chemical Society. 135: 6588-600. PMID 23611430 DOI: 10.1021/Ja4012657 |
0.483 |
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| 2013 |
Jiménez-Osés G, Brockway AJ, Shaw JT, Houk KN. Mechanism of alkoxy groups substitution by Grignard reagents on aromatic rings and experimental verification of theoretical predictions of anomalous reactions. Journal of the American Chemical Society. 135: 6633-42. PMID 23601086 DOI: 10.1021/Ja4015937 |
0.656 |
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| 2013 |
Breugst M, Eschenmoser A, Houk KN. Theoretical exploration of the mechanism of riboflavin formation from 6,7-dimethyl-8-ribityllumazine: nucleophilic catalysis, hydride transfer, hydrogen atom transfer, or nucleophilic addition? Journal of the American Chemical Society. 135: 6658-68. PMID 23550951 DOI: 10.1021/Ja402099F |
0.387 |
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| 2013 |
Miyazaki H, Herbert MB, Liu P, Dong X, Xu X, Keitz BK, Ung T, Mkrtumyan G, Houk KN, Grubbs RH. Z-Selective ethenolysis with a ruthenium metathesis catalyst: experiment and theory. Journal of the American Chemical Society. 135: 5848-58. PMID 23547887 DOI: 10.1021/Ja4010267 |
0.729 |
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| 2013 |
Krenske EH, He S, Huang J, Du Y, Houk KN, Hsung RP. Intramolecular oxyallyl-carbonyl (3 + 2) cycloadditions. Journal of the American Chemical Society. 135: 5242-5. PMID 23544997 DOI: 10.1021/Ja312459B |
0.695 |
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| 2013 |
Kiss G, Çelebi-Ölçüm N, Moretti R, Baker D, Houk KN. Computational enzyme design. Angewandte Chemie (International Ed. in English). 52: 5700-25. PMID 23526810 DOI: 10.1002/Anie.201204077 |
0.629 |
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| 2013 |
Dieckmann A, Richers MT, Platonova AY, Zhang C, Seidel D, Houk KN. Metal-free α-amination of secondary amines: computational and experimental evidence for azaquinone methide and azomethine ylide intermediates. The Journal of Organic Chemistry. 78: 4132-44. PMID 23517448 DOI: 10.1021/Jo400483H |
0.341 |
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| 2013 |
Zou L, Paton RS, Eschenmoser A, Newhouse TR, Baran PS, Houk KN. Enhanced reactivity in dioxirane C-H oxidations via strain release: a computational and experimental study. The Journal of Organic Chemistry. 78: 4037-48. PMID 23461537 DOI: 10.1021/Jo400350V |
0.682 |
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| 2013 |
Kiss G, Pande VS, Houk KN. Molecular dynamics simulations for the ranking, evaluation, and refinement of computationally designed proteins Methods in Enzymology. 523: 145-170. PMID 23422429 DOI: 10.1016/B978-0-12-394292-0.00007-2 |
0.584 |
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| 2013 |
Rosenker CJ, Krenske EH, Houk KN, Wipf P. Influence of base and structure in the reversible covalent conjugate addition of thiol to polycyclic enone scaffolds. Organic Letters. 15: 1076-9. PMID 23405884 DOI: 10.1021/Ol400094K |
0.649 |
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| 2013 |
Wang H, Mei J, Liu P, Schmidt K, Jiménez-Osés G, Osuna S, Fang L, Tassone CJ, Zoombelt AP, Sokolov AN, Houk KN, Toney MF, Bao Z. Scalable and selective dispersion of semiconducting arc-discharged carbon nanotubes by dithiafulvalene/thiophene copolymers for thin film transistors. Acs Nano. 7: 2659-68. PMID 23402644 DOI: 10.1021/Nn4000435 |
0.592 |
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| 2013 |
Lopez SA, Munk ME, Houk KN. Mechanisms and transition states of 1,3-dipolar cycloadditions of phenyl azide with enamines: A computational analysis Journal of Organic Chemistry. 78: 1576-1582. PMID 23347077 DOI: 10.1021/Jo302695N |
0.648 |
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| 2013 |
Bjelic S, Nivón LG, Çelebi-Ölçüm N, Kiss G, Rosewall CF, Lovick HM, Ingalls EL, Gallaher JL, Seetharaman J, Lew S, Montelione GT, Hunt JF, Michael FE, Houk KN, Baker D. Computational design of enone-binding proteins with catalytic activity for the Morita-Baylis-Hillman reaction. Acs Chemical Biology. 8: 749-57. PMID 23330600 DOI: 10.1021/Cb3006227 |
0.652 |
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| 2013 |
Wang H, Jain P, Antilla JC, Houk KN. Origins of stereoselectivities in chiral phosphoric acid catalyzed allylborations and propargylations of aldehydes. The Journal of Organic Chemistry. 78: 1208-15. PMID 23298338 DOI: 10.1021/Jo302787M |
0.385 |
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| 2013 |
Hong X, Liu P, Houk KN. Mechanism and origins of ligand-controlled selectivities in [Ni(NHC)]-catalyzed intramolecular (5 + 2) cycloadditions and homo-ene reactions: a theoretical study. Journal of the American Chemical Society. 135: 1456-62. PMID 23273283 DOI: 10.1021/Ja309873Z |
0.545 |
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| 2013 |
Lin H, Pei W, Wang H, Houk KN, Krauss IJ. Enantioselective homocrotylboration of aliphatic aldehydes Journal of the American Chemical Society. 135: 82-85. PMID 23256566 DOI: 10.1021/Ja311061N |
0.349 |
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| 2013 |
Wang H, Liu F, Helgeson RC, Houk KN. Reversible photochemically gated transformation of a hemicarcerand to a carcerand. Angewandte Chemie (International Ed. in English). 52: 655-9. PMID 23172821 DOI: 10.1002/Anie.201205376 |
0.31 |
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| 2013 |
Du Y, Krenske EH, Antoline JE, Lohse AG, Houk KN, Hsung RP. Control of regioselectivity and stereoselectivity in (4 + 3) cycloadditions of chiral oxyallyls with unsymmetrically disubstituted furans. The Journal of Organic Chemistry. 78: 1753-9. PMID 22849303 DOI: 10.1021/Jo3011792 |
0.657 |
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| 2013 |
Krenske EH, Houk KN. Aromatic interactions as control elements in stereoselective organic reactions Accounts of Chemical Research. 46: 979-989. PMID 22827883 DOI: 10.1021/Ar3000794 |
0.688 |
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| 2013 |
Lopez SA, Houk KN. Alkene distortion energies and torsional effects control reactivities, and stereoselectivities of azide cycloadditions to norbornene and substituted norbornenes Journal of Organic Chemistry. 78: 1778-1783. PMID 22764840 DOI: 10.1021/Jo301267B |
0.703 |
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| 2013 |
Loiseleur O, Cassayre J, Leca D, Gaggini F, Pieniazek SN, Luft JAR, Houk KN. Control of hetero-diels-alder stereoselectivity through solvent polarity and bronsted or lewis acid catalysis; Theory and experiment Synlett. 24: 2446-2450. DOI: 10.1055/S-0033-1340046 |
0.765 |
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| 2013 |
Fang L, Liu P, Sveinbjornsson BR, Atahan-Evrenk S, Vandewal K, Osuna S, Jiménez-Osés G, Shrestha S, Giri G, Wei P, Salleo A, Aspuru-Guzik A, Grubbs RH, Houk KN, Bao Z. Confined organization of fullerene units along high polymer chains Journal of Materials Chemistry C. 1: 5747-5755. DOI: 10.1039/C3Tc31158A |
0.681 |
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| 2013 |
Dieckmann A, Houk KN. Analysis of supramolecular complex energetics in artificial replicators Chemical Science. 4: 3591-3600. DOI: 10.1039/C3Sc51192H |
0.303 |
|
| 2013 |
Lopez SA, Munk ME, Houk KN. Correction to Mechanisms and Transition States of 1,3-Dipolar Cycloadditions of Phenyl Azide with Enamines: A Computational Analysis The Journal of Organic Chemistry. 78: 5115-5115. DOI: 10.1021/Jo400863U |
0.632 |
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| 2013 |
Dieckmann A, Breugst M, Houk KN. Zwitterions and unobserved intermediates in organocatalytic diels-alder reactions of linear and cross-conjugated trienamines Journal of the American Chemical Society. 135: 3237-3242. DOI: 10.1021/Ja312043G |
0.426 |
|
| 2012 |
Bigi MA, Liu P, Zou L, Houk KN, White MC. Cafestol to Tricalysiolide B and Oxidized Analogues: Biosynthetic and Derivatization Studies Using Non-heme Iron Catalyst Fe(PDP). Synlett : Accounts and Rapid Communications in Synthetic Organic Chemistry. 23: 2768-2772. PMID 23585710 DOI: 10.1055/S-0032-1317708 |
0.556 |
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| 2012 |
Lam YH, Houk KN, Cossy J, Prado DG, Cochi A. H12461. Fluorine as a Regiocontrol Element in the Ring Openings of Bicyclic Aziridiniums. Helvetica Chimica Acta. 95: 2265-2277. PMID 23471532 DOI: 10.1002/Hlca.201200461 |
0.342 |
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| 2012 |
Matute RA, Houk KN. The triplet surface of the Zimmerman di-π-methane rearrangement of dibenzobarrelene. Angewandte Chemie (International Ed. in English). 51: 13097-100. PMID 23184767 DOI: 10.1002/Anie.201208002 |
0.732 |
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| 2012 |
Liang Y, Mackey JL, Lopez SA, Liu F, Houk KN. Control and design of mutual orthogonality in bioorthogonal cycloadditions. Journal of the American Chemical Society. 134: 17904-7. PMID 23061442 DOI: 10.1021/Ja309241E |
0.688 |
|
| 2012 |
Yang X, Bumbu VD, Liu P, Li X, Jiang H, Uffman EW, Guo L, Zhang W, Jiang X, Houk KN, Birman VB. Catalytic, enantioselective N-acylation of lactams and thiolactams using amidine-based catalysts. Journal of the American Chemical Society. 134: 17605-12. PMID 23030692 DOI: 10.1021/Ja306766N |
0.492 |
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| 2012 |
Petric A, Johnson SA, Pham HV, Li Y, Ceh S, Golobic A, Agdeppa ED, Timbol G, Liu J, Keum G, Satyamurthy N, Kepe V, Houk KN, Barrio JR. Dicyanovinylnaphthalenes for neuroimaging of amyloids and relationships of electronic structures and geometries to binding affinities. Proceedings of the National Academy of Sciences of the United States of America. 109: 16492-7. PMID 23012452 DOI: 10.1073/Pnas.1214134109 |
0.539 |
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| 2012 |
Kheirabadi M, Çelebi-Ölçüm N, Parker MF, Zhao Q, Kiss G, Houk KN, Schafmeister CE. Spiroligozymes for transesterifications: design and relationship of structure to activity. Journal of the American Chemical Society. 134: 18345-53. PMID 22992057 DOI: 10.1021/Ja3069648 |
0.605 |
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| 2012 |
Wang H, Kohler P, Overman LE, Houk KN. Origins of stereoselectivities of dihydroxylations of cis-bicyclo[3.3.0]octenes. Journal of the American Chemical Society. 134: 16054-8. PMID 22954350 DOI: 10.1021/Ja3075538 |
0.407 |
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| 2012 |
Schnermann MJ, Untiedt NL, Jiménez-Osés G, Houk KN, Overman LE. Forming tertiary organolithiums and organocuprates from nitrile precursors and their bimolecular reactions with carbon electrophiles to form quaternary carbon stereocenters. Angewandte Chemie (International Ed. in English). 51: 9581-6. PMID 22927041 DOI: 10.1002/Anie.201205001 |
0.605 |
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| 2012 |
Yang X, Liu P, Houk KN, Birman VB. Manifestation of Felkin-Anh control in enantioselective acyl transfer catalysis: kinetic resolution of carboxylic acids. Angewandte Chemie (International Ed. in English). 51: 9638-42. PMID 22915544 DOI: 10.1002/Anie.201203327 |
0.427 |
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| 2012 |
Nosrati GR, Houk KN. Using catalytic atom maps to predict the catalytic functions present in enzyme active sites. Biochemistry. 51: 7321-9. PMID 22909276 DOI: 10.1021/Bi3008438 |
0.769 |
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| 2012 |
Bronner SM, Mackey JL, Houk KN, Garg NK. Steric effects compete with aryne distortion to control regioselectivities of nucleophilic additions to 3-silylarynes. Journal of the American Chemical Society. 134: 13966-9. PMID 22876797 DOI: 10.1021/Ja306723R |
0.376 |
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| 2012 |
Richter F, Blomberg R, Khare SD, Kiss G, Kuzin AP, Smith AJ, Gallaher J, Pianowski Z, Helgeson RC, Grjasnow A, Xiao R, Seetharaman J, Su M, Vorobiev S, Lew S, ... ... Houk KN, et al. Computational design of catalytic dyads and oxyanion holes for ester hydrolysis. Journal of the American Chemical Society. 134: 16197-206. PMID 22871159 DOI: 10.1021/Ja3037367 |
0.631 |
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| 2012 |
Giri R, Lan Y, Liu P, Houk KN, Yu JQ. Understanding reactivity and stereoselectivity in palladium-catalyzed diastereoselective sp3 C-H bond activation: intermediate characterization and computational studies. Journal of the American Chemical Society. 134: 14118-26. PMID 22830301 DOI: 10.1021/Ja304643E |
0.498 |
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| 2012 |
Krenske EH, Agopcan S, Aviyente V, Houk KN, Johnson BA, Holmes AB. Causation in a cascade: the origins of selectivities in intramolecular nitrone cycloadditions. Journal of the American Chemical Society. 134: 12010-5. PMID 22788115 DOI: 10.1021/Ja300002K |
0.685 |
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| 2012 |
Black K, Liu P, Xu L, Doubleday C, Houk KN. Dynamics, transition states, and timing of bond formation in Diels-Alder reactions. Proceedings of the National Academy of Sciences of the United States of America. 109: 12860-5. PMID 22753502 DOI: 10.1073/Pnas.1209316109 |
0.639 |
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| 2012 |
Bellomo A, Celebi-Olcum N, Bu X, Rivera N, Ruck RT, Welch CJ, Houk KN, Dreher SD. Rapid catalyst identification for the synthesis of the pyrimidinone core of HIV integrase inhibitors. Angewandte Chemie (International Ed. in English). 51: 6912-5. PMID 22689502 DOI: 10.1002/Anie.201201720 |
0.319 |
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| 2012 |
Liu P, Yang X, Birman VB, Houk KN. Origin of enantioselectivity in benzotetramisole-catalyzed dynamic kinetic resolution of azlactones. Organic Letters. 14: 3288-91. PMID 22686505 DOI: 10.1021/Ol301243F |
0.519 |
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| 2012 |
Khersonsky O, Kiss G, Röthlisberger D, Dym O, Albeck S, Houk KN, Baker D, Tawfik DS. Bridging the gaps in design methodologies by evolutionary optimization of the stability and proficiency of designed Kemp eliminase KE59. Proceedings of the National Academy of Sciences of the United States of America. 109: 10358-63. PMID 22685214 DOI: 10.1073/Pnas.1121063109 |
0.596 |
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| 2012 |
Xu X, Liu P, Lesser A, Sirois LE, Wender PA, Houk KN. Ligand effects on rates and regioselectivities of Rh(I)-catalyzed (5 + 2) cycloadditions: a computational study of cyclooctadiene and dinaphthocyclooctatetraene as ligands. Journal of the American Chemical Society. 134: 11012-25. PMID 22668243 DOI: 10.1021/Ja3041724 |
0.506 |
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| 2012 |
Krenske EH, Perry EW, Jerome SV, Maimone TJ, Baran PS, Houk KN. Why a proximity-induced Diels-Alder reaction is so fast. Organic Letters. 14: 3016-9. PMID 22630569 DOI: 10.1021/Ol301083Q |
0.678 |
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| 2012 |
Pham HV, Martin DB, Vanderwal CD, Houk KN. The Intramolecular Diels-Alder Reaction of Tryptamine-Derived Zincke Aldehydes Is a Stepwise Process. Chemical Science (Royal Society of Chemistry : 2010). 2012: 1650-1655. PMID 22611483 DOI: 10.1039/C2Sc01072K |
0.469 |
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| 2012 |
Felnagle EA, Chaubey A, Noey EL, Houk KN, Liao JC. Engineering synthetic recursive pathways to generate non-natural small molecules. Nature Chemical Biology. 8: 518-26. PMID 22596203 DOI: 10.1038/Nchembio.959 |
0.779 |
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| 2012 |
Gordon CG, Mackey JL, Jewett JC, Sletten EM, Houk KN, Bertozzi CR. Reactivity of biarylazacyclooctynones in copper-free click chemistry. Journal of the American Chemical Society. 134: 9199-208. PMID 22553995 DOI: 10.1021/Ja3000936 |
0.472 |
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| 2012 |
Sader CA, Houk KN. A theoretical study of cyclohexyne addition to carbonyl-Cα bonds: allowed and forbidden electrocyclic and nonpericyclic ring-openings of strained cyclobutenes. The Journal of Organic Chemistry. 77: 4939-48. PMID 22537557 DOI: 10.1021/Jo300314Z |
0.811 |
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| 2012 |
Herbert MB, Lan Y, Keitz BK, Liu P, Endo K, Day MW, Houk KN, Grubbs RH. Decomposition pathways of Z-selective ruthenium metathesis catalysts. Journal of the American Chemical Society. 134: 7861-6. PMID 22500642 DOI: 10.1021/Ja301108M |
0.473 |
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| 2012 |
Nosrati GR, Houk KN. SABER: a computational method for identifying active sites for new reactions. Protein Science : a Publication of the Protein Society. 21: 697-706. PMID 22492397 DOI: 10.1002/Pro.2055 |
0.783 |
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| 2012 |
Lam YH, Houk KN, Scheffler U, Mahrwald R. Stereoselectivities of histidine-catalyzed asymmetric aldol additions and contrasts with proline catalysis: a quantum mechanical analysis. Journal of the American Chemical Society. 134: 6286-95. PMID 22458689 DOI: 10.1021/Ja2118392 |
0.469 |
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| 2012 |
Hotta K, Chen X, Paton RS, Minami A, Li H, Swaminathan K, Mathews II, Watanabe K, Oikawa H, Houk KN, Kim CY. Enzymatic catalysis of anti-Baldwin ring closure in polyether biosynthesis. Nature. 483: 355-8. PMID 22388816 DOI: 10.1038/Nature10865 |
0.611 |
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| 2012 |
Privett HK, Kiss G, Lee TM, Blomberg R, Chica RA, Thomas LM, Hilvert D, Houk KN, Mayo SL. Iterative approach to computational enzyme design. Proceedings of the National Academy of Sciences of the United States of America. 109: 3790-5. PMID 22357762 DOI: 10.1073/Pnas.1118082108 |
0.587 |
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| 2012 |
Goetz AE, Bronner SM, Cisneros JD, Melamed JM, Paton RS, Houk KN, Garg NK. An efficient computational model to predict the synthetic utility of heterocyclic arynes. Angewandte Chemie (International Ed. in English). 51: 2758-62. PMID 22307724 DOI: 10.1002/Anie.201108863 |
0.6 |
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| 2012 |
Khakshoor O, Wheeler SE, Houk KN, Kool ET. Measurement and theory of hydrogen bonding contribution to isosteric DNA base pairs. Journal of the American Chemical Society. 134: 3154-63. PMID 22300089 DOI: 10.1021/Ja210475A |
0.568 |
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| 2012 |
DiRocco DA, Noey EL, Houk KN, Rovis T. Catalytic asymmetric intermolecular Stetter reactions of enolizable aldehydes with nitrostyrenes: computational study provides insight into the success of the catalyst. Angewandte Chemie (International Ed. in English). 51: 2391-4. PMID 22282312 DOI: 10.1002/Anie.201107597 |
0.796 |
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| 2012 |
Krenske EH, Davison EC, Forbes IT, Warner JA, Smith AL, Holmes AB, Houk KN. Reverse cope elimination of hydroxylamines and alkenes or alkynes: theoretical investigation of tether length and substituent effects. Journal of the American Chemical Society. 134: 2434-41. PMID 22280245 DOI: 10.1021/Ja211568K |
0.683 |
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| 2012 |
Marcheschi RJ, Li H, Zhang K, Noey EL, Kim S, Chaubey A, Houk KN, Liao JC. A synthetic recursive "+1" pathway for carbon chain elongation. Acs Chemical Biology. 7: 689-97. PMID 22242720 DOI: 10.1021/Cb200313E |
0.753 |
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| 2012 |
Liu P, Xu X, Dong X, Keitz BK, Herbert MB, Grubbs RH, Houk KN. Z-Selectivity in olefin metathesis with chelated Ru catalysts: computational studies of mechanism and selectivity. Journal of the American Chemical Society. 134: 1464-7. PMID 22229694 DOI: 10.1021/Ja2108728 |
0.715 |
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| 2012 |
Jain P, Wang H, Houk KN, Antilla JC. Brønsted acid catalyzed asymmetric propargylation of aldehydes. Angewandte Chemie (International Ed. in English). 51: 1391-4. PMID 22223476 DOI: 10.1002/Anie.201107407 |
0.451 |
|
| 2012 |
Noey EL, Luo Y, Zhang L, Houk KN. Mechanism of gold(I)-catalyzed rearrangements of acetylenic amine-N-oxides: computational investigations lead to a new mechanism confirmed by experiment. Journal of the American Chemical Society. 134: 1078-84. PMID 22191473 DOI: 10.1021/Ja208860X |
0.799 |
|
| 2012 |
Lan Y, Danheiser RL, Houk KN. Why nature eschews the concerted [2 + 2 + 2] cycloaddition of a nonconjugated cyanodiyne. Computational study of a pyridine synthesis involving an ene-Diels-Alder-bimolecular hydrogen-transfer mechanism. The Journal of Organic Chemistry. 77: 1533-8. PMID 22188179 DOI: 10.1021/Jo202424N |
0.452 |
|
| 2012 |
Bogdan AR, Jerome SV, Houk KN, James K. Strained cyclophane macrocycles: impact of progressive ring size reduction on synthesis and structure. Journal of the American Chemical Society. 134: 2127-38. PMID 22133103 DOI: 10.1021/Ja208503Y |
0.31 |
|
| 2012 |
List B, Wang Q, Yang X, Bumbu VD, Liu P, Li X, Jiang H, Uffman EW, Guo L, Zhang W, Jiang X, Houk KN, Birman VB. Amidine Catalyzed Kinetic Resolution of Lactams and Thiolactams Synfacts. 8: 1372-1372. DOI: 10.1055/S-0032-1317572 |
0.343 |
|
| 2012 |
Lan Y, Liu P, Newman SG, Lautens M, Houk KN. Theoretical study of Pd(0)-catalyzed carbohalogenation of alkenes: Mechanism and origins of reactivities and selectivities in alkyl halide reductive elimination from Pd(ii) species Chemical Science. 3: 1987-1995. DOI: 10.1039/C2Sc20103H |
0.493 |
|
| 2012 |
Dieckmann A, Houk KN. Elucidation of strong cooperative effects caused by dispersion interactions in a recognition-mediated diels-alder reaction Journal of Chemical Theory and Computation. 8: 5064-5071. DOI: 10.1021/Ct300655B |
0.334 |
|
| 2012 |
Alemán C, Bertran O, Houk KN, Padías AB, Hall HK. Thermodynamic and stereochemical aspects of the polymerizability of glycolide and lactide Theoretical Chemistry Accounts. 131. DOI: 10.1007/S00214-012-1133-Y |
0.33 |
|
| 2012 |
Matute RA, Houk KN. Inside Back Cover: The Triplet Surface of the Zimmerman Di-π-Methane Rearrangement of Dibenzobarrelene (Angew. Chem. Int. Ed. 52/2012) Angewandte Chemie International Edition. 51: 13179-13179. DOI: 10.1002/Anie.201209048 |
0.696 |
|
| 2012 |
Matute RA, Houk KN. Innenrücktitelbild: The Triplet Surface of the Zimmerman Di-π-Methane Rearrangement of Dibenzobarrelene (Angew. Chem. 52/2012) Angewandte Chemie. 124: 13355-13355. DOI: 10.1002/Ange.201209048 |
0.696 |
|
| 2012 |
Yu ZX, Liang Y, Houk KN, Wu YD, Zhang XH. Chem Is Try Computationally and Experimentally: How Will Computational Organic Chemistry Impact Organic Theories, Mechanisms, and Synthesis in the Twenty-First Century? Organic Chemistry - Breakthroughs and Perspectives. 561-601. DOI: 10.1002/9783527664801.ch15 |
0.703 |
|
| 2011 |
Lan Y, Wheeler SE, Houk KN. Extraordinary Difference in Reactivity of Ozone (OOO) and Sulfur Dioxide (OSO): A Theoretical Study. Journal of Chemical Theory and Computation. 7: 2104-2111. PMID 26606482 DOI: 10.1021/Ct200293W |
0.627 |
|
| 2011 |
Çelebi-Ölçüm N, Lam YH, Richmond E, Ling KB, Smith AD, Houk KN. Pericyclic cascade with chirality transfer: reaction pathway and origin of enantioselectivity of the hetero-Claisen approach to oxindoles. Angewandte Chemie (International Ed. in English). 50: 11478-82. PMID 21976415 DOI: 10.1002/Anie.201105412 |
0.419 |
|
| 2011 |
Lan Y, Zou L, Cao Y, Houk KN. Computational methods to calculate accurate activation and reaction energies of 1,3-dipolar cycloadditions of 24 1,3-dipoles. The Journal of Physical Chemistry. A. 115: 13906-20. PMID 21967148 DOI: 10.1021/Jp207563H |
0.494 |
|
| 2011 |
Xu L, Doubleday CE, Houk KN. Dynamics of carbene cycloadditions. Journal of the American Chemical Society. 133: 17848-54. PMID 21961828 DOI: 10.1021/Ja207051B |
0.487 |
|
| 2011 |
Hein JE, Burés J, Lam YH, Hughes M, Houk KN, Armstrong A, Blackmond DG. Enamine carboxylates as stereodetermining intermediates in prolinate catalysis. Organic Letters. 13: 5644-7. PMID 21958394 DOI: 10.1021/Ol2023533 |
0.388 |
|
| 2011 |
Paton RS, Kim S, Ross AG, Danishefsky SJ, Houk KN. Experimental Diels-Alder reactivities of cycloalkenones and cyclic dienes explained through transition-state distortion energies. Angewandte Chemie (International Ed. in English). 50: 10366-8. PMID 21910195 DOI: 10.1002/Anie.201103998 |
0.555 |
|
| 2011 |
Antoline JE, Krenske EH, Lohse AG, Houk KN, Hsung RP. Stereoselectivities and regioselectivities of (4 + 3) cycloadditions between allenamide-derived chiral oxazolidinone-stabilized oxyallyls and furans: experiment and theory. Journal of the American Chemical Society. 133: 14443-51. PMID 21851070 DOI: 10.1021/Ja205700P |
0.658 |
|
| 2011 |
Liu LP, Malhotra D, Jin Z, Paton RS, Houk KN, Hammond GB. Gold-catalyzed, intramolecular, oxygen-transfer reactions of 2-alkynyl-1,5-diketones or 2-alkynyl-5-ketoesters: scope, expansion, and mechanistic investigations on a new [4+2] cycloaddition. Chemistry (Weinheim An Der Bergstrasse, Germany). 17: 10690-9. PMID 21830243 DOI: 10.1002/Chem.201101448 |
0.61 |
|
| 2011 |
Cheong PH, Legault CY, Um JM, Çelebi-Ölçüm N, Houk KN. Quantum mechanical investigations of organocatalysis: mechanisms, reactivities, and selectivities. Chemical Reviews. 111: 5042-137. PMID 21707120 DOI: 10.1021/Cr100212H |
0.82 |
|
| 2011 |
Um JM, DiRocco DA, Noey EL, Rovis T, Houk KN. Quantum mechanical investigation of the effect of catalyst fluorination in the intermolecular asymmetric Stetter reaction. Journal of the American Chemical Society. 133: 11249-54. PMID 21675770 DOI: 10.1021/Ja202444G |
0.804 |
|
| 2011 |
Gilboa N, Wang H, Houk KN, Marek I. Axial preferences in allylations via the Zimmerman-Traxler transition state. Chemistry (Weinheim An Der Bergstrasse, Germany). 17: 8000-4. PMID 21647996 DOI: 10.1002/Chem.201101049 |
0.322 |
|
| 2011 |
Krenske EH, Petter RC, Zhu Z, Houk KN. Transition states and energetics of nucleophilic additions of thiols to substituted α,β-unsaturated ketones: substituent effects involve enone stabilization, product branching, and solvation. The Journal of Organic Chemistry. 76: 5074-81. PMID 21574592 DOI: 10.1021/Jo200761W |
0.673 |
|
| 2011 |
Wang H, Houk KN, Allen DA, Jung ME. Computational elucidation of the origins of reactivity and selectivity in non-aldol aldol rearrangements of cyclic epoxides. Organic Letters. 13: 3238-41. PMID 21568276 DOI: 10.1021/Ol2011488 |
0.345 |
|
| 2011 |
Liu P, Montgomery J, Houk KN. Ligand steric contours to understand the effects of N-heterocyclic carbene ligands on the reversal of regioselectivity in Ni-catalyzed reductive couplings of alkynes and aldehydes. Journal of the American Chemical Society. 133: 6956-9. PMID 21506540 DOI: 10.1021/Ja202007S |
0.447 |
|
| 2011 |
Quasdorf KW, Antoft-Finch A, Liu P, Silberstein AL, Komaromi A, Blackburn T, Ramgren SD, Houk KN, Snieckus V, Garg NK. Suzuki-Miyaura cross-coupling of aryl carbamates and sulfamates: experimental and computational studies. Journal of the American Chemical Society. 133: 6352-63. PMID 21456551 DOI: 10.1021/Ja200398C |
0.443 |
|
| 2011 |
Çelebi-Ölçüm N, Boal BW, Huters AD, Garg NK, Houk KN. Why do some Fischer indolizations fail? Journal of the American Chemical Society. 133: 5752-5. PMID 21443189 DOI: 10.1021/Ja201035B |
0.386 |
|
| 2011 |
Noey EL, Wang X, Houk KN. Selective gold(I)-catalyzed formation of tetracyclic indolines: a single transition structure and bifurcations lead to multiple products. The Journal of Organic Chemistry. 76: 3477-83. PMID 21428454 DOI: 10.1021/Jo200556F |
0.805 |
|
| 2011 |
Kim M, Hohman JN, Cao Y, Houk KN, Ma H, Jen AK, Weiss PS. Creating favorable geometries for directing organic photoreactions in alkanethiolate monolayers. Science (New York, N.Y.). 331: 1312-5. PMID 21393542 DOI: 10.1126/Science.1200830 |
0.34 |
|
| 2011 |
Liu P, Krische MJ, Houk KN. Mechanism and origins of regio- and enantioselectivities in RhI-catalyzed hydrogenative couplings of 1,3-diynes and activated carbonyl partners: intervention of a cumulene intermediate. Chemistry (Weinheim An Der Bergstrasse, Germany). 17: 4021-9. PMID 21365696 DOI: 10.1002/Chem.201002741 |
0.513 |
|
| 2011 |
Paton RS, Steinhardt SE, Vanderwal CD, Houk KN. Unraveling the mechanism of cascade reactions of zincke aldehydes. Journal of the American Chemical Society. 133: 3895-905. PMID 21351736 DOI: 10.1021/Ja107988B |
0.58 |
|
| 2011 |
Tadić JM, Xu L, Houk KN, Moortgat GK. Photooxidation of n-octanal in air: experimental and theoretical study. The Journal of Organic Chemistry. 76: 1614-20. PMID 21319759 DOI: 10.1021/jo102133m |
0.405 |
|
| 2011 |
Kuzmanich G, Spänig F, Tsai CK, Um JM, Hoekstra RM, Houk KN, Guldi DM, Garcia-Garibay MA. Oxyallyl exposed: an open-shell singlet with picosecond lifetimes in solution but persistent in crystals of a cyclobutanedione precursor. Journal of the American Chemical Society. 133: 2342-5. PMID 21299211 DOI: 10.1021/Ja109494B |
0.759 |
|
| 2011 |
Khersonsky O, Röthlisberger D, Wollacott AM, Murphy P, Dym O, Albeck S, Kiss G, Houk KN, Baker D, Tawfik DS. Optimization of the in-silico-designed kemp eliminase KE70 by computational design and directed evolution. Journal of Molecular Biology. 407: 391-412. PMID 21277311 DOI: 10.1016/J.Jmb.2011.01.041 |
0.607 |
|
| 2011 |
Hotta K, Chen X, Paton RS, Minami A, Li H, Swaminathan K, Mathews I, Watanabe K, Oikawa H, Houk KN, Kim C-. Structural study of enzymatic anti-Baldwin ring closure in polyether formation Acta Crystallographica Section a Foundations of Crystallography. 67: C216-C216. DOI: 10.1107/S0108767311094645 |
0.502 |
|
| 2011 |
Siegel JB, Zanghellini A, Lovick HM, Kiss G, Lambert AR, Clair JLS, Gallaher JL, Hilvert D, Gelb MH, Stoddard BL, Houk KN, Michael FE, Baker D. A Biocatalytic Diels-Alder Reaction Using a DesignedEnzyme Synfacts. 2011: 323-323. DOI: 10.1055/S-0030-1259455 |
0.67 |
|
| 2011 |
Cao Y, Houk KN. Computational assessment of 1,3-dipolar cycloadditions to graphene Journal of Materials Chemistry. 21: 1503-1508. DOI: 10.1039/C0Jm02422H |
0.303 |
|
| 2011 |
Lan Y, Wheeler SE, Houk KN. Extraordinary difference in reactivity of ozone (OOO) and sulfur dioxide (OSO): A theoretical study Journal of Chemical Theory and Computation. 7: 2104-2111. DOI: 10.1021/ct200293w |
0.521 |
|
| 2011 |
Krenske EH, Houk KN, Holmes AB, Thompson J. Entropy versus tether strain effects on rates of intramolecular 1,3-dipolar cycloadditions of N-alkenylnitrones Tetrahedron Letters. 52: 2181-2184. DOI: 10.1016/J.Tetlet.2010.11.121 |
0.664 |
|
| 2011 |
Liu P, Houk K. Theoretical studies of regioselectivity of Ni- and Rh-catalyzed C–C bond forming reactions with unsymmetrical alkynes Inorganica Chimica Acta. 369: 2-14. DOI: 10.1016/J.Ica.2010.12.042 |
0.537 |
|
| 2010 |
Dedeoglu B, Catak S, Houk KN, Aviyente V. A Theoretical Study of the Mechanism of the Desymmetrization of Cyclic meso-Anhydrides by Chiral Amino Alcohols. Chemcatchem. 2: 1122-1129. PMID 22368722 DOI: 10.1002/Cctc.201000065 |
0.369 |
|
| 2010 |
Krenske EH, Houk KN, Lohse AG, Antoline JE, Hsung RP. Stereoselectivity in Oxyallyl-Furan 4+3 Cycloadditions: Control of Intermediate Conformations and Dispersive Stabilisation with Evans' Oxazolidinones. Chemical Science (Royal Society of Chemistry : 2010). 1: 387-392. PMID 21572919 DOI: 10.1039/C0Sc00280A |
0.681 |
|
| 2010 |
Im GY, Bronner SM, Goetz AE, Paton RS, Cheong PH, Houk KN, Garg NK. Indolyne experimental and computational studies: synthetic applications and origins of selectivities of nucleophilic additions. Journal of the American Chemical Society. 132: 17933-44. PMID 21114321 DOI: 10.1021/Ja1086485 |
0.801 |
|
| 2010 |
Krenske EH, Houk KN, Lim D, Wengryniuk SE, Coltart DM. Origins of stereoselectivity in the α-alkylation of chiral hydrazones. The Journal of Organic Chemistry. 75: 8578-84. PMID 21070023 DOI: 10.1021/Jo1019877 |
0.654 |
|
| 2010 |
Lohse AG, Krenske EH, Antoline JE, Houk KN, Hsung RP. Regioselectivities of (4 + 3) cycloadditions between furans and oxazolidinone-substituted oxyallyls. Organic Letters. 12: 5506-9. PMID 21049917 DOI: 10.1021/Ol1023745 |
0.66 |
|
| 2010 |
Liu LP, Malhotra D, Paton RS, Houk KN, Hammond GB. The [4+2], not [2+2], mechanism occurs in the gold-catalyzed intramolecular oxygen transfer reaction of 2-alkynyl-1,5-diketones. Angewandte Chemie (International Ed. in English). 49: 9132-5. PMID 21031394 DOI: 10.1002/Anie.201005514 |
0.581 |
|
| 2010 |
Jung ME, Zhang TH, Lui RM, Gutierrez O, Houk KN. Synthesis of a trans,syn,trans-dodecahydrophenanthrene via a bicyclic transannular Diels-Alder reaction: intermediate for the synthesis of fusidic acid. The Journal of Organic Chemistry. 75: 6933-40. PMID 20843028 DOI: 10.1021/Jo101533H |
0.631 |
|
| 2010 |
Kiss G, Röthlisberger D, Baker D, Houk KN. Evaluation and ranking of enzyme designs. Protein Science : a Publication of the Protein Society. 19: 1760-73. PMID 20665693 DOI: 10.1002/Pro.462 |
0.615 |
|
| 2010 |
Siegel JB, Zanghellini A, Lovick HM, Kiss G, Lambert AR, St Clair JL, Gallaher JL, Hilvert D, Gelb MH, Stoddard BL, Houk KN, Michael FE, Baker D. Computational design of an enzyme catalyst for a stereoselective bimolecular Diels-Alder reaction. Science (New York, N.Y.). 329: 309-13. PMID 20647463 DOI: 10.1126/Science.1190239 |
0.682 |
|
| 2010 |
Allemann C, Um JM, Houk KN. Computational investigations of the stereoselectivities of proline-related catalysts for aldol reactions. Journal of Molecular Catalysis. a, Chemical. 324: 31-38. PMID 20634993 DOI: 10.1016/J.Molcata.2010.03.020 |
0.766 |
|
| 2010 |
Liu P, Sirois LE, Cheong PH, Yu ZX, Hartung IV, Rieck H, Wender PA, Houk KN. Electronic and steric control of regioselectivities in Rh(I)-catalyzed (5 + 2) cycloadditions: experiment and theory. Journal of the American Chemical Society. 132: 10127-35. PMID 20586494 DOI: 10.1021/Ja103253D |
0.829 |
|
| 2010 |
Paton RS, Mackey JL, Kim WH, Lee JH, Danishefsky SJ, Houk KN. Origins of stereoselectivity in the trans Diels-Alder paradigm. Journal of the American Chemical Society. 132: 9335-40. PMID 20557046 DOI: 10.1021/Ja1009162 |
0.651 |
|
| 2010 |
St-Cyr DJ, Morin MS, Bélanger-Gariépy F, Arndtsen BA, Krenske EH, Houk KN. Phospha-Münchnones: electronic structures and 1,3-dipolar cycloadditions. The Journal of Organic Chemistry. 75: 4261-73. PMID 20481447 DOI: 10.1021/Jo1008383 |
0.669 |
|
| 2010 |
Wheeler SE, Houk KN. Are anion/pi interactions actually a case of simple charge-dipole interactions? The Journal of Physical Chemistry. A. 114: 8658-64. PMID 20433187 DOI: 10.1021/Jp1010549 |
0.552 |
|
| 2010 |
Um JM, Kaka NS, Hodgson DM, Houk KN. Transition states and origins of 1,4-asymmetric induction in alkylations of 2,2,6-trialkylpiperidine enamines. Chemistry (Weinheim An Der Bergstrasse, Germany). 16: 6310-6. PMID 20411546 DOI: 10.1002/Chem.201000046 |
0.779 |
|
| 2010 |
Jones GO, Liu P, Houk KN, Buchwald SL. Computational explorations of mechanisms and ligand-directed selectivities of copper-catalyzed Ullmann-type reactions. Journal of the American Chemical Society. 132: 6205-13. PMID 20387898 DOI: 10.1021/Ja100739H |
0.759 |
|
| 2010 |
Um JM, Gutierrez O, Schoenebeck F, Houk KN, Macmillan DWC. Nature of intermediates in organo-somo catalysis of α-arylation of aldehydes Journal of the American Chemical Society. 132: 6001-6005. PMID 20387888 DOI: 10.1021/Ja9063074 |
0.805 |
|
| 2010 |
Wheeler SE, Houk KN. Integration Grid Errors for Meta-GGA-Predicted Reaction Energies: Origin of Grid Errors for the M06 Suite of Functionals. Journal of Chemical Theory and Computation. 6: 395-404. PMID 20305831 DOI: 10.1021/Ct900639J |
0.574 |
|
| 2010 |
Gül S, Schoenebeck F, Aviyente V, Houk KN. Computational study of factors controlling the boat and chair transition states of Ireland-Claisen rearrangements. The Journal of Organic Chemistry. 75: 2115-8. PMID 20166688 DOI: 10.1021/Jo100033D |
0.307 |
|
| 2010 |
Wheeler SE, McNeil AJ, Müller P, Swager TM, Houk KN. Probing substituent effects in aryl-aryl interactions using stereoselective Diels-Alder cycloadditions. Journal of the American Chemical Society. 132: 3304-11. PMID 20158182 DOI: 10.1021/Ja903653J |
0.641 |
|
| 2010 |
Xu L, Doubleday CE, Houk KN. Dynamics of 1,3-dipolar cycloadditions: energy partitioning of reactants and quantitation of synchronicity. Journal of the American Chemical Society. 132: 3029-37. PMID 20148587 DOI: 10.1021/Ja909372F |
0.537 |
|
| 2010 |
Schoenebeck F, Houk KN. Ligand-controlled regioselectivity in palladium-catalyzed cross coupling reactions. Journal of the American Chemical Society. 132: 2496-7. PMID 20121156 DOI: 10.1021/Ja9077528 |
0.308 |
|
| 2010 |
Liu P, McCarren P, Cheong PH, Jamison TF, Houk KN. Origins of regioselectivity and alkene-directing effects in nickel-catalyzed reductive couplings of alkynes and aldehydes. Journal of the American Chemical Society. 132: 2050-7. PMID 20095609 DOI: 10.1021/Ja909562Y |
0.79 |
|
| 2010 |
Krenske EH, Houk KN, Harmata M. Origin of stereoselectivity in the (4 + 3) cycloadditions of chiral alkoxy siloxyallyl cations with furan. Organic Letters. 12: 444-7. PMID 20063884 DOI: 10.1021/Ol902591K |
0.627 |
|
| 2010 |
Hargis JC, Schaefer HF, Houk KN, Wheeler SE. Noncovalent interactions of a benzo[a]pyrene diol epoxide with DNA base pairs: insight into the formation of adducts of (+)-BaP DE-2 with DNA. The Journal of Physical Chemistry. A. 114: 2038-44. PMID 20063873 DOI: 10.1021/Jp911376P |
0.554 |
|
| 2010 |
Cheong PH, Paton RS, Bronner SM, Im GY, Garg NK, Houk KN. Indolyne and aryne distortions and nucleophilic regioselectivites. Journal of the American Chemical Society. 132: 1267-9. PMID 20058924 DOI: 10.1021/Ja9098643 |
0.803 |
|
| 2010 |
Hayden AE, Paton RS, Becker J, Lim YH, Nicolaou KC, Houk KN. Origins of regioselectivity of Diels-Alder reactions for the synthesis of bisanthraquinone antibiotic BE-43472B. The Journal of Organic Chemistry. 75: 922-8. PMID 20027998 DOI: 10.1021/Jo902572Y |
0.645 |
|
| 2010 |
Celebi-Olçüm N, Aviyente V, Houk KN. Mechanism and selectivity of cinchona alkaloid catalyzed [1,3]-shifts of allylic trichloroacetimidates. The Journal of Organic Chemistry. 74: 6944-52. PMID 19689147 DOI: 10.1021/Jo901109S |
0.45 |
|
| 2010 |
Barman DN, Liu P, Houk KN, Nicholas KM. On the mechanism of ligand-assisted, copper-catalyzed benzylic amination by chloramine-T Organometallics. 29: 3404-3412. DOI: 10.1021/Om100427S |
0.507 |
|
| 2010 |
Krenske EH, Houk KN, Harmata M. Origin of stereoselectivity in the (4 + 3) cycloadditions of chiral alkoxy siloxyallyl cations with furan Organic Letters. 12: 444-447. DOI: 10.1021/ol902591k |
0.58 |
|
| 2010 |
Lan Y, Houk KN. Mechanism and stereoselectivity of the stepwise 1,3-dipolar cycloadditions between a thiocarbonyl ylide and electron-deficient dipolarophiles: A computational investigation Journal of the American Chemical Society. 132: 17921-17927. DOI: 10.1021/Ja108432B |
0.416 |
|
| 2010 |
Liu P, Sirois LE, Cheong PH, Yu Z, Hartung IV, Rieck H, Wender PA, Houk KN. ChemInform Abstract: Electronic and Steric Control of Regioselectivities in Rh(I)-Catalyzed [5 + 2] Cycloadditions: Experiment and Theory. Cheminform. 42: no-no. DOI: 10.1002/chin.201102071 |
0.595 |
|
| 2010 |
WIEST O, HOUK KN. ChemInform Abstract: Density Functional Theory Calculations of Pericyclic Reaction Transition Structures Cheminform. 28: no-no. DOI: 10.1002/chin.199714335 |
0.55 |
|
| 2010 |
THOMAS BEI, EVANSECK JD, HOUK KN. ChemInform Abstract: Transition Structures of the Electrocyclic Reactions of cis,cis,cis-1, 3,5-Cyclooctatriene Cheminform. 25: no-no. DOI: 10.1002/chin.199414041 |
0.592 |
|
| 2010 |
NAHM K, LI Y, EVANSECK JD, HOUK KN, FOOTE CS. ChemInform Abstract: Structures and Energies of Intermediates in the Reactions of Singlet Oxygen with Organic Phosphines and Sulfides. Cheminform. 24: no-no. DOI: 10.1002/chin.199341121 |
0.702 |
|
| 2010 |
THOMAS BEI, EVANSECK JD, HOUK KN. ChemInform Abstract: Electrocyclic Reactions of 1-Substituted 1,3,5,7-Octatetraenes (I) and (II). An ab initio Molecular Orbital Study of Torquoselectivity in Eight-Electron Electrocyclizations. Cheminform. 24: no-no. DOI: 10.1002/chin.199341035 |
0.638 |
|
| 2010 |
HOUK KN, LI Y, EVANSECK JD. ChemInform Abstract: Transition Structures of Hydrocarbon Pericyclic Reactions Cheminform. 23: no-no. DOI: 10.1002/chin.199238322 |
0.642 |
|
| 2010 |
EVANSECK JD, HOUK KN. ChemInform Abstract: Stereoselectivity of Hydrogen 1,2-Shifts in Singlet Alkylcarbenes: A Quantitative Theoretical Assessment of Ground-State Orbital Alignment and Torsional and Steric Effects Cheminform. 22: no-no. DOI: 10.1002/chin.199112101 |
0.601 |
|
| 2009 |
Wheeler SE, Houk KN. Through-Space Effects of Substituents Dominate Molecular Electrostatic Potentials of Substituted Arenes. Journal of Chemical Theory and Computation. 5: 2301-2312. PMID 20161573 DOI: 10.1021/Ct900344G |
0.596 |
|
| 2009 |
Canterbury DP, Herrick IR, Um J, Houk KN, Frontier AJ. A Torquoselective Extrusion of Isoxazoline N-Oxides. Application to the Synthesis of Aryl Vinyl and Divinyl Ketones for Nazarov Cyclization. Tetrahedron. 65: 3165-3179. PMID 20161228 DOI: 10.1016/J.Tet.2008.10.003 |
0.757 |
|
| 2009 |
Wheeler SE, Houk KN. Origin of Substituent Effects in Edge-to-Face Aryl-Aryl Interactions. Molecular Physics. 107: 749-760. PMID 20046948 DOI: 10.1080/00268970802537614 |
0.606 |
|
| 2009 |
Chen X, Regan CK, Craig SL, Krenske EH, Houk KN, Jorgensen WL, Brauman JI. Steric and solvation effects in ionic S(N)2 reactions. Journal of the American Chemical Society. 131: 16162-70. PMID 19842649 DOI: 10.1021/Ja9053459 |
0.627 |
|
| 2009 |
Gutierrez O, Iafe RG, Houk KN. Origin of stereoselectivity in the imidazolidinone-catalyzed reductions of cyclic alpha,beta-unsaturated ketones. Organic Letters. 11: 4298-301. PMID 19722547 DOI: 10.1021/Ol901586T |
0.608 |
|
| 2009 |
Wheeler SE, Moran A, Pieniazek SN, Houk KN. Accurate reaction enthalpies and sources of error in DFT thermochemistry for aldol, Mannich, and alpha-aminoxylation reactions. The Journal of Physical Chemistry. A. 113: 10376-84. PMID 19711937 DOI: 10.1021/Jp9058565 |
0.824 |
|
| 2009 |
Hayden AE, DeChancie J, George AH, Dai M, Yu M, Danishefsky SJ, Houk KN. Origins of the regioselectivities in the Diels-Alder reactions of vinylindenes with 1,4-quinone monoketal and acrolein dienophiles. The Journal of Organic Chemistry. 74: 6770-6. PMID 19663431 DOI: 10.1021/Jo901473H |
0.458 |
|
| 2009 |
Alemán C, Betran O, Casanovas J, Houk KN, Hall HK. Thermodynamic control of the polymerizability of five-, six-, and seven-membered lactones. The Journal of Organic Chemistry. 74: 6237-44. PMID 19606838 DOI: 10.1021/Jo9010969 |
0.35 |
|
| 2009 |
Jackson MI, Han TH, Serbulea L, Dutton A, Ford E, Miranda KM, Houk KN, Wink DA, Fukuto JM. Kinetic feasibility of nitroxyl reduction by physiological reductants and biological implications. Free Radical Biology & Medicine. 47: 1130-9. PMID 19577638 DOI: 10.1016/J.Freeradbiomed.2009.06.034 |
0.351 |
|
| 2009 |
Krenske EH, Pryor WA, Houk KN. Mechanism of S(H)2 reactions of disulfides: frontside vs backside, stepwise vs concerted. The Journal of Organic Chemistry. 74: 5356-60. PMID 19548657 DOI: 10.1021/Jo900834M |
0.625 |
|
| 2009 |
Smith AJ, Li Y, Houk KN. Quantum mechanics/molecular mechanics investigation of the mechanism of phosphate transfer in human uridine-cytidine kinase 2. Organic & Biomolecular Chemistry. 7: 2716-24. PMID 19532987 DOI: 10.1039/B901429B |
0.388 |
|
| 2009 |
Schoenebeck F, Ess DH, Jones GO, Houk KN. Reactivity and regioselectivity in 1,3-dipolar cycloadditions of azides to strained alkynes and alkenes: a computational study. Journal of the American Chemical Society. 131: 8121-33. PMID 19459632 DOI: 10.1021/Ja9003624 |
0.718 |
|
| 2009 |
Um JM, Xu H, Houk KN, Tang W. Thermodynamic control of the electrocyclic ring opening of cyclobutenes: C=X substituents at C-3 mask the kinetic torquoselectivity. Journal of the American Chemical Society. 131: 6664-5. PMID 19402639 DOI: 10.1021/Ja9016446 |
0.767 |
|
| 2009 |
McCarren PR, Liu P, Cheong PH, Jamison TF, Houk KN. Mechanism and transition-state structures for nickel-catalyzed reductive alkyne-aldehyde coupling reactions. Journal of the American Chemical Society. 131: 6654-5. PMID 19397371 DOI: 10.1021/Ja900701G |
0.772 |
|
| 2009 |
Gunaydin H, Houk KN. Mechanisms of peroxynitrite-mediated nitration of tyrosine. Chemical Research in Toxicology. 22: 894-8. PMID 19374346 DOI: 10.1021/Tx800463Y |
0.362 |
|
| 2009 |
Garcia Y, Schoenebeck F, Legault CY, Merlic CA, Houk KN. Theoretical bond dissociation energies of halo-heterocycles: trends and relationships to regioselectivity in palladium-catalyzed cross-coupling reactions. Journal of the American Chemical Society. 131: 6632-9. PMID 19368385 DOI: 10.1021/Ja9004927 |
0.706 |
|
| Show low-probability matches. |
