Recent developments and applications of the CHARMM force fields
Advanced Review
Xiao Zhu, Pedro E. M. Lopes, Alexander D. MacKerell
Published Online: Jun 28 2011
DOI:10.1002/wcms.74
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Molecular Mechanics
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Overview
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DOI:10.1002/wcms.1399
On flexible force fields for metal–organic frameworks: Recent developments and future prospects
Advanced Review
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DOI:10.1002/wcms.1363
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DOI:10.1002/wcms.1359
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DOI:10.1002/wcms.1346
Recent advances in dynamic docking for drug discovery
Opinion
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Published Online: Jun 13 2017
DOI:10.1002/wcms.1320
Accelerating physical simulations of proteins by leveraging external knowledge
Advanced Review
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Published Online: Apr 19 2017
DOI:10.1002/wcms.1309
Using PyMOL as a platform for computational drug design
Software Focus
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DOI:10.1002/wcms.1298
Polarizable force fields for molecular dynamics simulations of biomolecules
Overview
Christopher M. Baker
Published Online: Jan 26 2015
DOI:10.1002/wcms.1215
Recent successes in coarse‐grained modeling of DNA
Advanced Review
Davit A. Potoyan, Alexey Savelyev, Garegin A. Papoian
Published Online: Aug 08 2012
DOI:10.1002/wcms.1114
Carbohydrate force fields
Advanced Review
B. Lachele Foley, Matthew B. Tessier, Robert J. Woods
Published Online: Oct 31 2011
DOI:10.1002/wcms.89