APPLICATION OF GENETIC ALGORITHMS IN MOLECULAR MODELING

被引：54
|
作者：
BRODMEIER, T [1 ]
PRETSCH, E [1 ]
机构：
[1] ETH ZURICH,DEPT ORGAN CHEM,CH-8092 ZURICH,SWITZERLAND
来源：
JOURNAL OF COMPUTATIONAL CHEMISTRY | 1994年 / 15卷 / 06期
关键词：
D O I：
10.1002/jcc.540150604
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
A genetic algorithm has been developed for molecular mechanics calculations. It has been proved to be a robust and efficient structure optimization technique. Because it uses randomly generated starting structures and stochastic operators, the resulting structures are not subjected to the chemist's bias. (C) 1994 by John Wiley & Sons, Inc.
引用
收藏
页码：588 / 595
页数：8
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