Generalized-ensemble Monte Carlo algorithms for simulations of proteins

被引:0
|
作者
Mitsutake, A [1 ]
Sugita, Y [1 ]
Okamoto, Y [1 ]
机构
[1] Keio Univ, Fac Sci & Technol, Dept Phys, Yokohama, Kanagawa 2238522, Japan
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暂无
中图分类号
TQ174 [陶瓷工业]; TB3 [工程材料学];
学科分类号
0805 ; 080502 ;
摘要
We have developed new generalized-ensemble algorithms for Monte Carlo version. Some of new generalized-ensemble algorithms are the replica-exchange multicanonical algorithm, multicanonical replica-exchange method, and the replica-exchange simulated tempering. In this paper, the comparisons of performances of these algorithms are made, taking an example of a 17-residue helical peptide.
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页码:350 / 351
页数:2
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