Conformational transitions of heteropolymers

被引：5
|
作者：
Bachmann, M [1 ]
Janke, W [1 ]
机构：
[1] Univ Leipzig, Inst Theoret Phys, D-04109 Leipzig, Germany
来源：
COMPUTER PHYSICS COMMUNICATIONS | 2005年 / 169卷 / 1-3期
关键词：
conformational transitions; heteropolymers; proteins; multicanonical sampling;
D O I：
10.1016/j.cpc.2005.03.026
中图分类号：
TP39 [计算机的应用];
学科分类号：
081203 ; 0835 ;
摘要：
We study conformational transitions of simple coarse-grained models for protein-like heteropolymers on the simple cubic lattice and off-lattice, respectively, by means of multicanonical sampling algorithms. The effective hydrophobic/polar models do not require the knowledge of the native topology for a given sequence of residues as input. Therefore these models are eligible to investigate general properties of the tertiary folding behavior of such protein-like heteropolymers. (c) 2005 Elsevier B.V. All rights reserved.
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页码：111 / 113
页数：3
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