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Bin Zhang
Bin Zhang
在 schrodinger.com 的电子邮件经过验证
标题
引用次数
引用次数
年份
The “weighted ensemble” path sampling method is statistically exact for a broad class of stochastic processes and binning procedures
BW Zhang, D Jasnow, DM Zuckerman
The Journal of chemical physics 132 (5), 2010
2072010
Efficient and verified simulation of a path ensemble for conformational change in a united-residue model of calmodulin
BW Zhang, D Jasnow, DM Zuckerman
Proceedings of the National academy of Sciences 104 (46), 18043-18048, 2007
1552007
Steady-state simulations using weighted ensemble path sampling
D Bhatt, BW Zhang, DM Zuckerman
The Journal of chemical physics 133 (1), 2010
1262010
Transition-event durations in one-dimensional activated processes
BW Zhang, D Jasnow, DM Zuckerman
The Journal of chemical physics 126 (7), 2007
1062007
Chaperone activation by unfolding
L Foit, JS George, BW Zhang, CL Brooks III, JCA Bardwell
Proceedings of the national Academy of Sciences 110 (14), E1254-E1262, 2013
812013
Probing pH-dependent dissociation of HdeA dimers
BW Zhang, L Brunetti, CL Brooks III
Journal of the American Chemical Society 133 (48), 19393-19398, 2011
502011
Simulating replica exchange: Markov state models, proposal schemes, and the infinite swapping limit
BW Zhang, W Dai, E Gallicchio, P He, J Xia, Z Tan, RM Levy
The Journal of Physical Chemistry B 120 (33), 8289-8301, 2016
492016
Comparing alchemical and physical pathway methods for computing the absolute binding free energy of charged ligands
N Deng, D Cui, BW Zhang, J Xia, J Cruz, R Levy
Physical Chemistry Chemical Physics 20 (25), 17081-17092, 2018
412018
A Stochastic Solution to the Unbinned WHAM Equations
BW Zhang, J Xia, Z Tan, RM Levy
The Journal of Physical Chemistry Letters 6, 3834--3840, 2015
342015
The Role of Interfacial Water in Protein–Ligand Binding: Insights from the Indirect Solvent Mediated Potential of Mean Force
D Cui, BW Zhang, N Matubayasi, RM Levy
Journal of chemical theory and computation 14 (2), 512-526, 2018
292018
pHsensitive residues in the p19 RNA silencing suppressor protein from carnation Italian ringspot virus affect siRNA binding stability
SM Law, BW Zhang, CL Brooks III
Protein Science 22 (5), 595-604, 2013
282013
Largescale asynchronous and distributed multidimensional replica exchange molecular simulations and efficiency analysis
J Xia, WF Flynn, E Gallicchio, BW Zhang, P He, Z Tan, RM Levy
Journal of computational chemistry 36 (23), 1772-1785, 2015
262015
Locally weighted histogram analysis and stochastic solution for large-scale multi-state free energy estimation
Z Tan, J Xia, BW Zhang, RM Levy
The Journal of Chemical Physics 144 (3), 2016
192016
Absolute Protein Binding Free Energy Simulations for Ligands with Multiple Poses, a Thermodynamic Path That Avoids Exhaustive Enumeration of the Poses
Y Sakae, BW Zhang, RM Levy, N Deng
Journal of Computational Chemistry 41 (1), 56-68, 2020
172020
Spatially-decomposed free energy of solvation based on the endpoint density-functional method
Y Ishii, N Yamamoto, N Matubayasi, BW Zhang, D Cui, RM Levy
Journal of chemical theory and computation 15 (5), 2896-2912, 2019
162019
Relationship between Solvation Thermodynamics from IST and DFT Perspectives
RM Levy, D Cui, BW Zhang, N Matubayasi
The Journal of Physical Chemistry B, 2017
152017
Conformational Free Energy Changes via an Alchemical Path without Reaction Coordinates
P He, BW Zhang, S Arasteh, L Wang, R Abel, RM Levy
The journal of physical chemistry letters 9 (15), 4428-4435, 2018
132018
Connecting free energy surfaces in implicit and explicit solvent: an efficient method to compute conformational and solvation free energies
N Deng, BW Zhang, RM Levy
Journal of chemical theory and computation 11 (6), 2868-2878, 2015
132015
the UWHAM and sWHAM software package
BW Zhang, S Arasteh, RM Levy
Scientific reports 9 (1), 2803, 2019
122019
Stratified UWHAM and Its Stochastic Approximation for Multicanonical Simulations Which Are Far from Equilibrium
BW Zhang, N Deng, Z Tan, RM Levy
Journal of chemical theory and computation 13 (10), 4660-4674, 2017
112017
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