Conformational properties of compact polymers

被引:13
作者
Bohn, Manfred [1 ]
Heermann, Dieter W. [1 ]
机构
[1] Univ Heidelberg, Inst Theoret Phys, D-69120 Heidelberg, Germany
关键词
DNA; Monte Carlo methods; polymers; SELF-AVOIDING WALK; INTERPHASE CHROMOSOMES; MODEL; SEQUENCE; LATTICE; ALGORITHM; CHROMATIN; PROTEINS; CHAIN; SHAPE;
D O I
10.1063/1.3126651
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Monte Carlo simulations of coarse-grained polymers provide a useful tool to deepen the understanding of conformational and statistical properties of polymers both in physical as well as in biological systems. In this study we sample compact conformations on a cubic LxLxL lattice with different occupancy fractions by modifying a recently proposed algorithm. The system sizes studied extend up to N=256 000 monomers, going well beyond the limits of older publications on compact polymers. We analyze several conformational properties of these polymers, including segment correlations and screening of excluded volume. Most importantly we propose a scaling law for the end-to-end distance distribution and analyze the moments of this distribution. It shows universality with respect to different occupancy fractions, i.e., system densities. We further analyze the distance distribution between intrachain segments, which turns out to be of great importance for biological experiments. We apply these new findings to the problem of chromatin folding inside interphase nuclei and show that-although chromatin is in a compacted state-the classical theory of compact polymers does not explain recent experimental results.
引用
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页数:11
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