TOPOLOGICAL APPROACH TO DRUG DESIGN

被引：207

作者：

GALVEZ, J

GARCIADOMENECH, R

DEJULIANORTIZ, JV

SOLER, R

机构：

[1] Unit Research into Molecular Connectivity, Drug Design, Department of Physical Chemistry, Faculty of Pharmacy, University of Valencia

来源：

JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES | 1995年 / 35卷 / 02期

关键词：

D O I：

10.1021/ci00024a017

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

In this paper we demonstrate that by an adequate combination of different topological indices it is possible to select and design new active compounds in different therapeutical scopes, with a very high efficiency level. Particularly successful in the search of new ''lead drugs'', the results show the surprising ability of the topological methods to describe molecular structures.

引用

页码：272 / 284

页数：13

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