Recent progress in comparative molecular field analysis

被引：0

作者：

Hou, TJ ^{[1
]}

Xu, XJ ^{[1
]}

机构：

[1] Peking Univ, Coll Chem & Mol Engn, Beijing 100871, Peoples R China

来源：

PROGRESS IN CHEMISTRY | 2001年 / 13卷 / 06期

关键词：

comparative molecular field analysis (CoMFA); QSAR; 3D-QSAR; genetic algorithm;

D O I：

暂无

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

Comparative molecular field analysis (CoMFA) may be the most widely used technique in three-dimensional quantitative structure-activity relationships. But the conventional CoMFA exists some defects, including the selection of potential function of molecular field, the determination of bioactive conformers, the molecular alignment and the selection of variable of molecular fields, etc. In this paper, the recent progress in CoMFA, as well as some research work in our lab are introduced. With these improvements, CoMFA will play more important role in computer aided drug design.

引用

页码：436 / 440

页数：5

共 30 条

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