Modeling supramolecular assemblages

被引：16
作者：
Elcock, AH [1 ]
机构：
[1] Univ Iowa, Dept Biochem, Iowa City, IA 52242 USA
来源：
CURRENT OPINION IN STRUCTURAL BIOLOGY | 2002年 / 12卷 / 02期
关键词：
D O I：
10.1016/S0959-440X(02)00303-2
中图分类号：
Q5 [生物化学]; Q7 [分子生物学];
学科分类号：
071010 ; 081704 ;
摘要：
There has been some progress (but not much) in simulating supramolecular assemblages in the past year. The two main technical advances have been, firstly, the establishment of a protocol for extracting equilibrium thermodynamic data from forced (i.e. nonequilibrium) simulations and experiments, and, secondly, the development of a method for accurately calculating the electrostatics of enormous systems. Some recent applications have demonstrated the increasing feasibility of performing meaningful simulations of very large systems.
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收藏
页码：154 / 160
页数：7
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