Monte Carlo simulations of semi-flexible polymers

被引:0
作者
Paul, W [1 ]
Muller, M [1 ]
Binder, K [1 ]
Stukan, MR [1 ]
Ivanov, VA [1 ]
机构
[1] Johannes Gutenberg Univ Mainz, Inst Phys, D-55099 Mainz, Germany
来源
COMPUTER SIMULATIONS OF LIQUID CRYSTALS AND POLYMERS | 2005年 / 177卷
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中图分类号
TP39 [计算机的应用];
学科分类号
081203 ; 0835 ;
摘要
We present Monte Carlo simulations on the phase behavior of semiflexible macromolecules. For a single chain this question is of biophysical interest given the fact that long and stiff DNA chains are typically folded up into very tight compartments. So one can ask the question how the state diagram of a semiflexible chain differs from the coil-globule behavior of a flexible macromolecule. Another effect connected with rigidity of the chains is their tendency to aggregate and form nematically ordered structures. As a consequence one has two competing phase transitions: a gas-liquid and an isotropic-nematic transition potentially giving rise to a complicated phase diagram.
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页码:171 / 190
页数:20
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