| Year |
Citation |
Score |
| 2021 |
Mhashal AR, Major DT. Temperature-Dependent Kinetic Isotope Effects in R67 Dihydrofolate Reductase from Path-Integral Simulations. The Journal of Physical Chemistry. B. PMID 33522797 DOI: 10.1021/acs.jpcb.0c10318 |
0.553 |
|
| 2020 |
Mhashal AR, Romero-Rivera A, Mydy LS, Cristobal JR, Gulick AM, Richard JP, Kamerlin SCL. Modeling the Role of a Flexible Loop and Active Site Side Chains in Hydride Transfer Catalyzed by Glycerol-3-phosphate Dehydrogenase. Acs Catalysis. 10: 11253-11267. PMID 33042609 DOI: 10.1021/Acscatal.0C02757 |
0.36 |
|
| 2019 |
Das S, Shimshi M, Raz K, Nitoker Eliaz N, Mhashal AR, Ansbacher T, Major DT. EnzyDock: Protein-Ligand Docking of Multiple Reactive States Along a Reaction Coordinate in Enzymes. Journal of Chemical Theory and Computation. PMID 31386808 DOI: 10.1021/Acs.Jctc.9B00366 |
0.568 |
|
| 2018 |
Mhashal AR, Pshetitsky Y, Cheatum CM, Kohen A, Major DT. Evolutionary Effects on Bound Substrate pKa in Dihydrofolate Reductase. Journal of the American Chemical Society. PMID 30398861 DOI: 10.1021/Jacs.8B09089 |
0.587 |
|
| 2018 |
Driller R, Janke S, Fuchs M, Warner E, Mhashal AR, Major DT, Christmann M, Brück T, Loll B. Towards a comprehensive understanding of the structural dynamics of a bacterial diterpene synthase during catalysis. Nature Communications. 9: 3971. PMID 30266969 DOI: 10.1038/S41467-018-06325-8 |
0.558 |
|
| 2018 |
Mhashal AR, Pshetitsky Y, Eitan R, Cheatum CM, Kohen A, Major DT. Effect of Asp122 Mutation on the Hydride Transfer in E. Coli DHFR Demonstrates the Goldilocks of Enzyme Flexibility. The Journal of Physical Chemistry. B. PMID 30040418 DOI: 10.1021/Acs.Jpcb.8B05556 |
0.536 |
|
| 2017 |
Mhashal AR, Vardi-Kilshtain A, Kohen A, Major DT. The Role of the M20 Loop in the Hydride Transfer in E. Coli Dihydrofolate Reductase. The Journal of Biological Chemistry. PMID 28620051 DOI: 10.1074/Jbc.M117.777136 |
0.535 |
|
| 2016 |
Mhashal AR, Roy S. Free Energy of Bare and Capped Gold Nanoparticle Permeating Through Lipid Bilayer. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 27595236 DOI: 10.1002/Cphc.201600690 |
0.551 |
|
| 2016 |
Dixit M, Das S, Mhashal AR, Eitan R, Major DT. Practical Aspects of Multiscale Classical and Quantum Simulations of Enzyme Reactions. Methods in Enzymology. 577: 251-86. PMID 27498641 DOI: 10.1016/Bs.Mie.2016.05.046 |
0.635 |
|
| 2016 |
Hevroni BL, Major DT, Dixit M, Mhashal AR, Das S, Fischer B. Nucleoside-2',3'/3',5'-bis(thio)phosphate antioxidants are also capable of disassembly of amyloid beta42-Zn(ii)/Cu(ii) aggregates via Zn(ii)/Cu(ii)-chelation. Organic & Biomolecular Chemistry. PMID 27109038 DOI: 10.1039/C6Ob00613B |
0.616 |
|
| 2016 |
Dalal S, Mhashal A, Kadoo N, Gaikwad SM. Functional stability and structural transitions of Kallikrein: spectroscopic and molecular dynamics studies. Journal of Biomolecular Structure & Dynamics. 1-13. PMID 26986006 DOI: 10.1080/07391102.2016.1138884 |
0.39 |
|
| 2016 |
Mhashal AR, Choudhury CK, Roy S. Probing the ATP-induced conformational flexibility of the PcrA helicase protein using molecular dynamics simulation. Journal of Molecular Modeling. 22: 54. PMID 26860503 DOI: 10.1007/S00894-016-2922-3 |
0.636 |
|
| 2015 |
Mhashal AR, Roy S. Self-assembly of phospholipids on flat supports. Physical Chemistry Chemical Physics : Pccp. PMID 26540275 DOI: 10.1039/C5Cp03358F |
0.536 |
|
| 2014 |
Mhashal AR, Roy S. Effect of gold nanoparticle on structure and fluidity of lipid membrane. Plos One. 9: e114152. PMID 25469786 DOI: 10.1371/Journal.Pone.0114152 |
0.558 |
|
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