Year |
Citation |
Score |
2024 |
Sameera WMC, Senevirathne B, Andersson S, Al-Ibadi M, Hidaka H, Kouchi A, Nyman G, Watanabe N. Correction to "CHO Radical Binding on Hexagonal Water Ice and Amorphous Solid Water". The Journal of Physical Chemistry. A. 128: 1397. PMID 38350652 DOI: 10.1021/acs.jpca.4c00513 |
0.642 |
|
2023 |
Sameera WMC, Jayaweera AP, Ishibashi A, Hidaka H, Oba Y, Watanabe N. A systematic mechanistic survey on the reactions between OH radical and CHOH on ice. Faraday Discussions. PMID 37335277 DOI: 10.1039/d3fd00033h |
0.382 |
|
2020 |
Sameera WMC, Senevirathne B, Andersson S, Al-Lbadi M, Hidaka H, Kouchi A, Nyman G, Watanabe N. CHO Radical Binding on Hexagonal Water Ice and Amorphous Solid Water. The Journal of Physical Chemistry. A. PMID 33370120 DOI: 10.1021/acs.jpca.0c09111 |
0.649 |
|
2020 |
Wakasugi C, Yoshida M, Sameera WMC, Shigeta Y, Kobayashi A, Kato M. Bright Luminescent Platinum(II)-biaryl Emitters Synthesized Without Air-sensitive Reagents. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 32086967 DOI: 10.1002/chem.201905821 |
0.586 |
|
2018 |
Ogawa T, Sameera WMC, Saito D, Yoshida M, Kobayashi A, Kato M. Phosphorescence Properties of Discrete Platinum(II) Complex Anions Bearing N-Heterocyclic Carbenes in the Solid State. Inorganic Chemistry. PMID 30354093 DOI: 10.1021/Acs.Inorgchem.8B01654 |
0.546 |
|
2018 |
Sameera WMC, Maseras F. Expanding the range of force fields available for ONIOM calculations: the SICTWO interface. Journal of Chemical Information and Modeling. PMID 30137980 DOI: 10.1021/Acs.Jcim.8B00332 |
0.62 |
|
2018 |
Pérez PJ, Olmos A, Gava R, Noverges B, Belleza D, Jacob K, Besora M, Sameera WMC, Etienne M, Maseras F, Asensio G, Caballero A. Measuring the relative reactivity of the carbon-hydrogen bonds of alkanes as nucleophiles. Angewandte Chemie (International Ed. in English). PMID 30015368 DOI: 10.1002/Anie.201807448 |
0.582 |
|
2018 |
Liang P, Kobayashi A, Sameera WMC, Yoshida M, Kato M. Solvent-Free Thermal Synthesis of Luminescent Dinuclear Cu(I) Complexes with Triarylphosphines. Inorganic Chemistry. PMID 29741380 DOI: 10.1021/Acs.Inorgchem.8B00439 |
0.454 |
|
2018 |
Ogawa T, Sameera WMC, Yoshida M, Kobayashi A, Kato M. Luminescent ionic liquids based on cyclometalated platinum(ii) complexes exhibiting thermochromic behaviour in different colour regions. Dalton Transactions (Cambridge, England : 2003). PMID 29589867 DOI: 10.1039/C8Dt00651B |
0.534 |
|
2017 |
Sharma AK, Sameera WMC, Jin M, Adak L, Okuzono C, Iwamoto T, Kato M, Nakamura M, Morokuma K. DFT and AFIR Study on the Mechanism and the Origin of Enantioselectivity in Iron-Catalyzed Cross-Coupling Reactions. Journal of the American Chemical Society. PMID 29017323 DOI: 10.1021/Jacs.7B05917 |
0.505 |
|
2017 |
Yang MC, Sharma AK, Sameera WM, Morokuma K, Su MD. A Theoretical Study of Addition Reactions of L4M(M = Rh, Ir) and L2M(M = Pd, Pt) to Li+@C60. The Journal of Physical Chemistry. A. PMID 28301165 DOI: 10.1021/Acs.Jpca.7B01086 |
0.514 |
|
2017 |
Maestre L, Dorel R, Pablo O, Escofet I, Sameera WM, Álvarez E, Maseras F, Diaz-Requejo MM, Echavarren AM, Pérez PJ. Functional-Group-Tolerant, Silver-Catalyzed N-N Bond Formation by Nitrene Transfer to Amines. Journal of the American Chemical Society. PMID 28099010 DOI: 10.1021/Jacs.6B08219 |
0.592 |
|
2016 |
Takeda Y, Kuroda A, Sameera WMC, Morokuma K, Minakata S. Palladium-catalyzed regioselective and stereo-invertive ring-opening borylation of 2-arylaziridines with bis(pinacolato)diboron: experimental and computational studies. Chemical Science. 7: 6141-6152. PMID 30034753 DOI: 10.1039/C6Sc01120A |
0.56 |
|
2016 |
Sharma D, Sameera W, Andersson S, Nyman G, Paterson MJ. Computational study of the interactions between benzene and crystalline ice Ih: Ground and excited states. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 27649519 DOI: 10.1002/Cphc.201600660 |
0.577 |
|
2016 |
Sameera WM, Kumar Sharma A, Maeda S, Morokuma K. Artificial Force Induced Reaction Method for Systematic Determination of Complex Reaction Mechanisms. Chemical Record (New York, N.Y.). PMID 27492586 DOI: 10.1002/tcr.201600052 |
0.529 |
|
2016 |
Sasaki S, Suzuki S, Sameera WM, Igawa K, Morokuma K, Konishi GI. Highly twisted N,N-dialkylamines as a design strategy to tune simple aromatic hydrocarbons as steric environment-sensitive fluorophores. Journal of the American Chemical Society. PMID 27300152 DOI: 10.1021/Jacs.6B03749 |
0.484 |
|
2016 |
Funes-Ardoiz I, Sameera WM, Romero RM, Martínez C, Souto JA, Sampedro D, Muñiz K, Maseras F. DFT Rationalization of the Diverse Outcomes of the Iodine(III)-Mediated Oxidative Amination of Alkenes. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 27106535 DOI: 10.1002/Chem.201600415 |
0.623 |
|
2016 |
Sameera WM, Maeda S, Morokuma K. Computational Catalysis Using the Artificial Force Induced Reaction Method. Accounts of Chemical Research. PMID 27023677 DOI: 10.1021/acs.accounts.6b00023 |
0.541 |
|
2016 |
Takeda Y, Kuroda A, Sameera WMC, Morokuma K, Minakata S. Palladium-catalyzed regioselective and stereo-invertive ring-opening borylation of 2-arylaziridines with bis(pinacolato)diboron: Experimental and computational studies Chemical Science. 7: 6141-6152. DOI: 10.1039/c6sc01120a |
0.559 |
|
2015 |
Sameera WM, Hatanaka M, Kitanosono T, Kobayashi S, Morokuma K. The Mechanism of Iron(II)-Catalyzed Asymmetric Mukaiyama Aldol Reaction in Aqueous Media: Density Functional Theory and Artificial Force-Induced Reaction Study. Journal of the American Chemical Society. 137: 11085-94. PMID 26267294 DOI: 10.1021/jacs.5b05835 |
0.544 |
|
2015 |
Chung LW, Sameera WM, Ramozzi R, Page AJ, Hatanaka M, Petrova GP, Harris TV, Li X, Ke Z, Liu F, Li HB, Ding L, Morokuma K. The ONIOM Method and Its Applications. Chemical Reviews. 115: 5678-796. PMID 25853797 DOI: 10.1021/Cr5004419 |
0.596 |
|
2015 |
Besora M, Braga AAC, Sameera WMC, Urbano J, Fructos MR, Pérez PJ, Maseras F. A computational view on the reactions of hydrocarbons with coinage metal complexes Journal of Organometallic Chemistry. 784: 2-12. DOI: 10.1016/J.Jorganchem.2014.10.009 |
0.624 |
|
2014 |
Llaveria J, Beltrán Á, Sameera WM, Locati A, Díaz-Requejo MM, Matheu MI, Castillón S, Maseras F, Pérez PJ. Chemo-, regio-, and stereoselective silver-catalyzed aziridination of dienes: scope, mechanistic studies, and ring-opening reactions. Journal of the American Chemical Society. 136: 5342-50. PMID 24621209 DOI: 10.1021/Ja412547R |
0.614 |
|
2013 |
Rivilla I, Sameera WM, Alvarez E, Díaz-Requejo MM, Maseras F, Pérez PJ. Catalytic cross-coupling of diazo compounds with coinage metal-based catalysts: an experimental and theoretical study. Dalton Transactions (Cambridge, England : 2003). 42: 4132-8. PMID 23328754 DOI: 10.1039/C2Dt32439C |
0.602 |
|
2013 |
Maestre L, Sameera WM, Díaz-Requejo MM, Maseras F, Pérez PJ. A general mechanism for the copper- and silver-catalyzed olefin aziridination reactions: concomitant involvement of the singlet and triplet pathways. Journal of the American Chemical Society. 135: 1338-48. PMID 23276287 DOI: 10.1021/Ja307229E |
0.638 |
|
2012 |
Sameera WMC, Maseras F. Transition metal catalysis by density functional theory and density functional theory/molecular mechanics Wiley Interdisciplinary Reviews: Computational Molecular Science. 2: 375-385. DOI: 10.1002/Wcms.1092 |
0.605 |
|
2011 |
Sameera WM, Maseras F. Quantum mechanics/molecular mechanics methods can be more accurate than full quantum mechanics in systems involving dispersion correlations. Physical Chemistry Chemical Physics : Pccp. 13: 10520-6. PMID 21512705 DOI: 10.1039/C0Cp02957B |
0.571 |
|
2011 |
Muñoz-Molina JM, Sameera WM, Álvarez E, Maseras F, Belderrain TR, Pérez PJ. Mechanistic and computational studies of the atom transfer radical addition of CCl4 to styrene catalyzed by copper homoscorpionate complexes. Inorganic Chemistry. 50: 2458-67. PMID 21319785 DOI: 10.1021/Ic102279W |
0.603 |
|
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