검색결과 : 114건
| No. | Article |
|---|---|
| 1 |
Simulated Force Quench Dynamics Shows GB1 Protein Is Not a Two State Folder Berkovich R, Mondal J, Paster I, Berne BJ Journal of Physical Chemistry B, 121(20), 5162, 2017 |
| 2 |
How a Kinase Inhibitor Withstands Gatekeeper Residue Mutations Mondal J, Tiwary P, Berne BJ Journal of the American Chemical Society, 138(13), 4608, 2016 |
| 3 |
Accurate and Reliable Prediction of Relative Ligand Binding Potency in Prospective Drug Discovery by Way of a Modern Free-Energy Calculation Protocol and Force Field Wang L, Wu YJ, Deng YQ, Kim B, Pierce L, Krilov G, Lupyan D, Robinson S, Dahlgren MK, Greenwood J, Romero DL, Masse C, Knight JL, Steinbrecher T, Beuming T, Damm W, Harder E, Sherman W, Brewer M, Wester R, Murcko M, Frye L, Farid R, Lin T, Mobley DL, Jorgensen WL, Berne BJ, Friesner RA, Abel R Journal of the American Chemical Society, 137(7), 2695, 2015 |
| 4 |
Interface-Limited Growth of Heterogeneously Nucleated Ice in Supercooled Water Nistor RA, Markland TE, Berne BJ Journal of Physical Chemistry B, 118(3), 752, 2014 |
| 5 |
When Does Trimethylamine N-Oxide Fold a Polymer Chain and Urea Unfold It? Mondal J, Stirnemann G, Berne BJ Journal of Physical Chemistry B, 117(29), 8723, 2013 |
| 6 |
Interplay between Hydrodynamics and the Free Energy Surface in the Assembly of Nanoscale Hydrophobes Morrone JA, Li J, Berne BJ Journal of Physical Chemistry B, 116(1), 378, 2012 |
| 7 |
Are Hydrodynamic Interactions Important in the Kinetics of Hydrophobic Collapse? Li JY, Morrone JA, Berne BJ Journal of Physical Chemistry B, 116(37), 11537, 2012 |
| 8 |
Comment on "Urea-Mediated Protein Denaturation: A Consensus View" Zhou RH, Li JY, Hua L, Yang ZX, Berne BJ Journal of Physical Chemistry B, 115(5), 1323, 2011 |
| 9 |
Replica Exchange with Solute Scaling: A More Efficient Version of Replica Exchange with Solute Tempering (REST2) Wang LL, Friesner RA, Berne BJ Journal of Physical Chemistry B, 115(30), 9431, 2011 |
| 10 |
Replica Exchange with Solute Scaling: A More Efficient Version of Replica Exchange with Solute Tempering (REST2) (vol 115, pg 9431, 2011) Wang L, Friesner RA, Berne BJ Journal of Physical Chemistry B, 115(38), 11305, 2011 |