CHARMM: A program for macromolecular energy, minimization, and dynamics calculations
Bernard R. Brooks;Robert E. Bruccoleri;Barry D. Olafson;David J. States.
Journal of Computational Chemistry (1983)
CHARMM: the biomolecular simulation program.
B. R. Brooks;C. L. Brooks;A. D. Mackerell;L. Nilsson.
Journal of Computational Chemistry (2009)
Constant pressure molecular dynamics simulation: The Langevin piston method
Scott E. Feller;Yuhong Zhang;Richard W. Pastor;Bernard R. Brooks.
Journal of Chemical Physics (1995)
Advances in molecular quantum chemistry contained in the Q-Chem 4 program package
Yihan Shao;Zhengting Gan;Evgeny Epifanovsky;Andrew T. B. Gilbert.
Molecular Physics (2015)
New spherical-cutoff methods for long-range forces in macromolecular simulation
Peter J. Steinbach;Bernard R. Brooks.
Journal of Computational Chemistry (1994)
OpenMM 7: Rapid development of high performance algorithms for molecular dynamics.
Peter Eastman;Jason Swails;John D. Chodera;Robert T. McGibbon.
PLOS Computational Biology (2017)
Harmonic dynamics of proteins: normal modes and fluctuations in bovine pancreatic trypsin inhibitor.
Bernard Brooks;Martin Karplus.
Proceedings of the National Academy of Sciences of the United States of America (1983)
An analysis of the accuracy of Langevin and molecular dynamics algorithms
Richard W. Pastor;Bernard R. Brooks;Attila Szabo.
Molecular Physics (1988)
Langevin dynamics of peptides: The frictional dependence of isomerization rates of N‐acetylalanyl‐N′‐methylamide
Richard J. Loncharich;Bernard R. Brooks;Richard W. Pastor.
Biopolymers (1992)
CHARMM: The Energy Function and Its Parameterization
Alexander D. MacKerell;Bernard Brooks;Charles L. Brooks;Lennart Nilsson.
Encyclopedia of Computational Chemistry (2002)
If you think any of the details on this page are incorrect, let us know.
We appreciate your kind effort to assist us to improve this page, it would be helpful providing us with as much detail as possible in the text box below:
National Institutes of Health
Harvard University
Ghent University
The University of Texas at Austin
University of Georgia
Ghent University
University of Maryland, Baltimore
University of British Columbia
University of Utah
Washington University in St. Louis
London Business School
Boston Dynamics (United States)
Soochow University
University of Alberta
Keele University
Tokyo Medical and Dental University
University of Utah
Woolcock Institute of Medical Research
University of Oklahoma Health Sciences Center
Chinese Academy of Sciences
University of Arizona
Agricultural Research Service
University of Central Florida
University of Michigan–Ann Arbor
University of Bristol
National and Kapodistrian University of Athens