| Year |
Citation |
Score |
| 2023 |
Shamsudin Y, Walker AR, Jones CM, Martínez TJ, Boxer SG. Simulation-guided engineering of split GFPs with efficient β-strand photodissociation. Nature Communications. 14: 7401. PMID 37973981 DOI: 10.1038/s41467-023-42954-4 |
0.427 |
|
| 2021 |
Walker AR, Wu B, Meisner J, Fayer MD, Martínez TJ. Proton Transfer from a Photoacid to a Water Wire: First Principles Simulations and Fast Fluorescence Spectroscopy. The Journal of Physical Chemistry. B. PMID 34743512 DOI: 10.1021/acs.jpcb.1c07254 |
0.414 |
|
| 2021 |
Berger MB, Walker AR, Vázquez-Montelongo EA, Cisneros GA. Computational investigations of selected enzymes from two iron and α-ketoglutarate-dependent families. Physical Chemistry Chemical Physics : Pccp. 23: 22227-22240. PMID 34586107 DOI: 10.1039/d1cp03800a |
0.582 |
|
| 2020 |
Thomaz JE, Walker AR, Van Wyck SJ, Meisner J, Martínez TJ, Fayer MD. Proton Transfer Dynamics in the Aprotic Proton Accepting Solvent 1-Methylimidazole. The Journal of Physical Chemistry. B. PMID 32790382 DOI: 10.1021/Acs.Jpcb.0C05525 |
0.469 |
|
| 2019 |
Walker AR, Baddam N, Cisneros GA. Unfolding Pathways of Hen Egg White Lysozyme in Ethanol. The Journal of Physical Chemistry. B. PMID 30912946 DOI: 10.1021/Acs.Jpcb.9B01694 |
0.547 |
|
| 2018 |
Gahlon HL, Walker AR, Cisneros GA, Lamers MH, Rueda DS. Reduced structural flexibility for an exonuclease deficient DNA polymerase III mutant. Physical Chemistry Chemical Physics : Pccp. PMID 30345999 DOI: 10.1039/C8Cp04112A |
0.676 |
|
| 2018 |
Antczak NM, Walker AR, Stern HR, Leddin EM, Palad C, Coulther TA, Swett RJ, Cisneros GA, Beuning PJ. Characterization of nine cancer-associated variants in human DNA polymerase κ. Chemical Research in Toxicology. PMID 30004685 DOI: 10.1021/Acs.Chemrestox.8B00055 |
0.554 |
|
| 2017 |
Liyanage PS, Walker AR, Brenlla A, Cisneros GA, Romano LJ, Rueda D. Bulky Lesion Bypass Requires Dpo4 Binding in Distinct Conformations. Scientific Reports. 7: 17383. PMID 29234107 DOI: 10.1038/S41598-017-17643-0 |
0.67 |
|
| 2017 |
Walker AR, Cisneros GA. Computational Simulations of DNA Polymerases: Detailed Insights on Structure/Function/Mechanism from Native Proteins to Cancer Variants. Chemical Research in Toxicology. PMID 28877429 DOI: 10.1021/Acs.Chemrestox.7B00161 |
0.686 |
|
| 2017 |
Walker AR, Silvestrov P, Müller TA, Podolsky RH, Dyson G, Hausinger RP, Cisneros GA. ALKBH7 Variant Related to Prostate Cancer Exhibits Altered Substrate Binding. Plos Computational Biology. 13: e1005345. PMID 28231280 DOI: 10.1371/Journal.Pcbi.1005345 |
0.698 |
|
| 2016 |
Walker AR, Bonomi R, Popov V, Gelovani JG, Andrés Cisneros G. Investigating carbohydrate based ligands for galectin-3 with docking and molecular dynamics studies. Journal of Molecular Graphics & Modelling. 71: 211-217. PMID 27939933 DOI: 10.1016/J.Jmgm.2016.10.018 |
0.302 |
|
| 2016 |
Kratz EG, Walker AR, Lagardère L, Lipparini F, Piquemal JP, Andrés Cisneros G. LICHEM: A QM/MM program for simulations with multipolar and polarizable force fields. Journal of Computational Chemistry. 37: 1019-29. PMID 26781073 DOI: 10.1002/Jcc.24295 |
0.62 |
|
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