Exploring the Parameter Space of the Coarse-Grained UNRES Force Field by Random Search: Selecting a Transferable Medium-Resolution Force Field

Yi He , Yi Xiao , Józef Adam Liwo , Harold A. Scheraga

Abstract

n/a
Author Yi He
Yi He,,
-
, Yi Xiao
Yi Xiao,,
-
, Józef Adam Liwo (FCh / DTCh / LMM)
Józef Adam Liwo,,
- Laboratory of Molecular Modeling
, Harold A. Scheraga
Harold A. Scheraga,,
-
Journal seriesJournal of Computational Chemistry, ISSN 0192-8651 [1096-987X], (A 35 pkt)
Issue year2009
Vol30
No13
Pages2127-2135
Keywords in Englishprotein folding, thermodynamic hypothesis, coarse-grained models, UNRES force field, force-field parameterization
DOIDOI:10.1002/jcc.21215
URL http://onlinelibrary.wiley.com/doi/10.1002/jcc.21215/pdf
Languageen angielski
Score (nominal)40
Publication indicators WoS Impact Factor: 2009 = 3.769 (2) - 2009=5.817 (5)
Citation count*60 (2018-12-13)
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