Combination of generalized-ensemble algorithms and one-dimensional reference interaction site model theory

The article reports an attempt to study the protein folding problem by generalized-ensemble Monte Carlo simulations with reference interaction site model theory. Generalized-ensemble algorithms greatly enhance the configurational space sampling in computer simulations. The reference interaction site...

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Bibliographic Details

Published in:	Condensed Matter Physics
Main Authors:	A.Mitsutake, M.Kinoshita, F.Hirata, Y.Okamoto
Format:	Article
Language:	English
Published:	Yukhnovskii Institute for Condensed Matter Physics of the National Academy of Sciences of Ukraine 2007-12-01
Subjects:	generalized-ensemble algorithm multicanonical algorithm replica-exchange method RISM Monte Carlo protein folding
Online Access:	http://dx.doi.org/10.5488/CMP.10.4.495