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Bernard R. Brooks
Bernard R. Brooks
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Title
Cited by
Cited by
Year
States DJ, Swaminathan S, Karplus M. CHARMM: a program for macromolecular energy, minimization, and dynamics calculations
BR Brooks, RE Bruccoleri, BD Olafson
J. comput. Chem 4 (2), 187-217, 1983
137891983
CHARMM: A program for macromolecular energy, minimization, and dynamics calculations
BR Brooks, RE Bruccoleri, BD Olafson, DJ States, S Swaminathan, ...
Journal of computational chemistry 4 (2), 187-217, 1983
11823*1983
CHARMM: the biomolecular simulation program
BR Brooks, CL Brooks III, AD Mackerell Jr, L Nilsson, RJ Petrella, B Roux, ...
Journal of computational chemistry 30 (10), 1545-1614, 2009
86322009
Constant pressure molecular dynamics simulation: The Langevin piston method
SE Feller, Y Zhang, RW Pastor, BR Brooks
The Journal of chemical physics 103 (11), 4613-4621, 1995
45711995
Advances in molecular quantum chemistry contained in the Q-Chem 4 program package
Y Shao, Z Gan, E Epifanovsky, ATB Gilbert, M Wormit, J Kussmann, ...
Molecular Physics 113 (2), 184-215, 2015
30462015
Encyclopedia of computational chemistry
WL Hase
Wiley, New York 1, 399-402, 1998
2577*1998
OpenMM 7: Rapid development of high performance algorithms for molecular dynamics
P Eastman, J Swails, JD Chodera, RT McGibbon, Y Zhao, KA Beauchamp, ...
PLoS computational biology 13 (7), e1005659, 2017
19672017
New spherical‐cutoff methods for long‐range forces in macromolecular simulation
PJ Steinbach, BR Brooks
Journal of computational chemistry 15 (7), 667-683, 1994
12631994
Langevin dynamics of peptides: The frictional dependence of isomerization rates of N‐acetylalanyl‐N′‐methylamide
RJ Loncharich, BR Brooks, RW Pastor
Biopolymers: Original Research on Biomolecules 32 (5), 523-535, 1992
10881992
Harmonic dynamics of proteins: normal modes and fluctuations in bovine pancreatic trypsin inhibitor.
B Brooks, M Karplus
Proceedings of the National Academy of Sciences 80 (21), 6571-6575, 1983
10711983
An analysis of the accuracy of Langevin and molecular dynamics algorithms
RW Pastor, BR Brooks, A Szabo
Molecular Physics 65 (6), 1409-1419, 1988
10131988
Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package
E Epifanovsky, ATB Gilbert, X Feng, J Lee, Y Mao, N Mardirossian, ...
The Journal of chemical physics 155 (8), 2021
6712021
PSI4 1.4: Open-source software for high-throughput quantum chemistry
DGA Smith, LA Burns, AC Simmonett, RM Parrish, MC Schieber, ...
The Journal of chemical physics 152 (18), 2020
6052020
Harmonic analysis of large systems. I. Methodology
BR Brooks, D Janežič, M Karplus
Journal of computational chemistry 16 (12), 1522-1542, 1995
6001995
Solvent-induced forces between two hydrophilic groups
SR Durell, BR Brooks, A Ben-Naim
The Journal of Physical Chemistry 98 (8), 2198-2202, 1994
5681994
Self-guided Langevin dynamics simulation method
X Wu, BR Brooks
Chemical Physics Letters 381 (3-4), 512-518, 2003
4842003
Normal modes for specific motions of macromolecules: application to the hinge-bending mode of lysozyme.
B Brooks, M Karplus
Proceedings of the National Academy of Sciences 82 (15), 4995-4999, 1985
4611985
Effect of electrostatic force truncation on interfacial and transport properties of water
SE Feller, RW Pastor, A Rojnuckarin, S Bogusz, BR Brooks
The Journal of Physical Chemistry 100 (42), 17011-17020, 1996
4511996
Computer simulation of liquid/liquid interfaces. I. Theory and application to octane/water
Y Zhang, SE Feller, BR Brooks, RW Pastor
The Journal of chemical physics 103 (23), 10252-10266, 1995
4401995
The graphical unitary group approach to the electron correlation problem. Methods and preliminary applications
BR Brooks, HF Schaefer III
The Journal of chemical physics 70 (11), 5092-5106, 1979
4141979
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