Application of Wang-Landau sampling to a protein model using SMMP

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We apply Wang-Landau sampling to the continuous energy model of a protein using Simple Molecular Mechanics for Protein (SMMP). We also tried to parallelize the Wang-Landau sampling method and compare our results With previous results derived from the multicanonical and parallel tempering methods.
Publisher
ELSEVIER SCIENCE BV
Issue Date
2010-01
Language
English
Article Type
Article
Citation

COMPUTER PHYSICS COMMUNICATIONS, v.181, no.1, pp.99 - 104

ISSN
0010-4655
DOI
10.1016/j.cpc.2009.09.004
URI
http://hdl.handle.net/10203/207240
Appears in Collection
RIMS Journal Papers
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