B. J. Berne or Bruce J Berne or Bruce Berne
B. J. Berne or Bruce J Berne or Bruce Berne
Higgins Professor of Chemistry
Zweryfikowany adres z columbia.edu
Tytuł
Cytowane przez
Cytowane przez
Rok
Dynamic light scattering: with applications to chemistry, biology, and physics
BJ Berne, R Pecora
Courier Corporation, 2000
109542000
Reversible multiple time scale molecular dynamics
M Tuckerman, BJ Berne, GJ Martyna
The Journal of chemical physics 97 (3), 1990-2001, 1992
36081992
Modification of the overlap potential to mimic a linear site–site potential
JG Gay, BJ Berne
The Journal of Chemical Physics 74 (6), 3316-3319, 1981
14071981
Dynamical fluctuating charge force fields: Application to liquid water
SW Rick, SJ Stuart, BJ Berne
The Journal of chemical physics 101 (7), 6141-6156, 1994
13791994
Integrated modeling program, applied chemical theory (IMPACT)
JL Banks, HS Beard, Y Cao, AE Cho, W Damm, R Farid, AK Felts, ...
Journal of computational chemistry 26 (16), 1752-1780, 2005
10912005
On the simulation of quantum systems: path integral methods
BJ Berne, D Thirumalai
Annual Review of Physical Chemistry 37 (1), 401-424, 1986
8381986
Correlation Functions
BJ Berne, GD Harp
Advances in chemical physics 17, 63, 2009
7762009
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
L Wang, Y Wu, Y Deng, B Kim, L Pierce, G Krilov, D Lupyan, S Robinson, ...
Journal of the American Chemical Society 137 (7), 2695-2703, 2015
7002015
Replica exchange with solute tempering: A method for sampling biological systems in explicit water
P Liu, B Kim, RA Friesner, BJ Berne
Proceedings of the National Academy of Sciences 102 (39), 13749-13754, 2005
6582005
Motifs for molecular recognition exploiting hydrophobic enclosure in protein–ligand binding
T Young, R Abel, B Kim, BJ Berne, RA Friesner
Proceedings of the National Academy of Sciences 104 (3), 808-813, 2007
6332007
Gaussian model potentials for molecular interactions
BJ Berne, P Pechukas
The Journal of Chemical Physics 56 (8), 4213-4216, 1972
6061972
Role of the active-site solvent in the thermodynamics of factor Xa ligand binding
R Abel, T Young, R Farid, BJ Berne, RA Friesner
Journal of the American Chemical Society 130 (9), 2817-2831, 2008
5992008
Hydrophobic collapse in multidomain protein folding
R Zhou, X Huang, CJ Margulis, BJ Berne
Science 305 (5690), 1605-1609, 2004
5642004
The free energy landscape for β hairpin folding in explicit water
R Zhou, BJ Berne, R Germain
Proceedings of the National Academy of Sciences 98 (26), 14931-14936, 2001
5472001
Efficient molecular dynamics and hybrid Monte Carlo algorithms for path integrals
ME Tuckerman, BJ Berne, GJ Martyna, ML Klein
The Journal of Chemical Physics 99 (4), 2796-2808, 1993
5021993
Urea denaturation by stronger dispersion interactions with proteins than water implies a 2-stage unfolding
L Hua, R Zhou, D Thirumalai, BJ Berne
Proceedings of the National Academy of Sciences 105 (44), 16928-16933, 2008
4862008
Replica exchange with solute scaling: a more efficient version of replica exchange with solute tempering (REST2)
L Wang, RA Friesner, BJ Berne
The Journal of Physical Chemistry B 115 (30), 9431-9438, 2011
4652011
On path integral Monte Carlo simulations
MF Herman, EJ Bruskin, BJ Berne
The Journal of Chemical Physics 76 (10), 5150-5155, 1982
4641982
A guide to Monte Carlo for statistical mechanics: 1. Highways
JP Valleau, SG Whittington
Statistical mechanics, 137-168, 1977
453*1977
Dewetting and hydrophobic interaction in physical and biological systems
BJ Berne, JD Weeks, R Zhou
Annual review of physical chemistry 60, 85-103, 2009
4422009
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