Brownian simulation of many-particle binding to a reversible receptor array

被引:26
作者
Edelstein, AL [1 ]
Agmon, N [1 ]
机构
[1] HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR,IL-91904 JERUSALEM,ISRAEL
基金
以色列科学基金会;
关键词
D O I
10.1006/jcph.1996.5617
中图分类号
TP39 [计算机的应用];
学科分类号
081203 ; 0835 ;
摘要
The principles and practice of a many-body Brownian dynamics algorithm of reversible binding to a static three-dimensional receptor array are presented. The mixed boundary conditions at the array are compared with single-particle direct propagation using a novel operator discretization. The many-body aspects are checked against previous one-dimensional Brownian simulations. The long-time behavior agrees with expected analytic solutions. (C) 1997 Academic Press.
引用
收藏
页码:260 / 275
页数:16
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