Automation of the CHARMM General Force Field (CGenFF) I: Bond Perception and Atom Typing

Published 2012 View Full Article

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Title
Automation of the CHARMM General Force Field (CGenFF) I: Bond Perception and Atom Typing
Authors
Keywords
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Journal
Journal of Chemical Information and Modeling
Volume 52, Issue 12, Pages 3144-3154
Publisher
American Chemical Society (ACS)
Online
2012-11-13
DOI
10.1021/ci300363c

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