CHARMM: The biomolecular simulation program

R. Brooks, B.; L. Brooks, C.; D. Mackerell, A.; Nilsson, L.; J. Petrella, R.; Roux, B.; Won, Y.; Archontis, G.; Bartels, C.; Boresch, S.; Caflisch, A.; Caves, L.; Cui, Q.; R. Dinner, A.; Feig, M.; Fischer, S.; Gao, J.; Hodoscek, M.; Im, W.; Kuczera, K.; Lazaridis, T.; Ma, J.; Ovchinnikov, V.; Paci, E.; W. Pastor, R.; B. Post, C.; Z. Pu, J.; Schaefer, M.; Tidor, B.; M. Venable, R.; L. Woodcock, H.; Wu, X.; Yang, W.; M. York, D.; Karplus, M.

doi:10.1002/jcc.21287

Public

CHARMM: The biomolecular simulation program

Shared by NobleBlocks on May 14, 2009 • 12:00 AM UTC

Authors:

B. R. Brooks

C. L. Brooks

A. D. Mackerell

Abstract

Abstract CHARMM (Chemistry at HARvard Molecular Mechanics) is a highly versatile and widely used molecular simulation program. It has been developed over the last three decades with a primary focus on molecules of biological interest, including proteins, peptides, lipids, nucleic acids, carbohydrate...

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