MOLECULAR SIMILARITY - THE INTRODUCTION OF FLEXIBLE FITTING

被引：32

作者：

BURT, C ^{[1
]}

RICHARDS, WG ^{[1
]}

机构：

[1] PHYS CHEM LAB,S PARKS RD,OXFORD OX1 3QZ,ENGLAND

来源：

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN | 1990年 / 4卷 / 03期

关键词：

Conformational flexibility; Electric field; Electrostatic potential; Similarity;

D O I：

10.1007/BF00125012

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：

A method of comparing molecules on a quantitative basis which includes the possibility of compounds using their flexibility to achieve matching is described and applied to a series of hypoglycemic and hypolipidemic agents. © 1990 ESCOM Science Publishers B.V.

引用

页码：231 / 238

页数：8

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