META .1. A PROGRAM FOR THE EVALUATION OF METABOLIC TRANSFORMATION OF CHEMICALS

被引：115

作者：

KLOPMAN, G

DIMAYUGA, M

TALAFOUS, J

机构：

[1] Chemistry Department, Case Western Reserve University, Cleveland

来源：

JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES | 1994年 / 34卷 / 06期

关键词：

D O I：

10.1021/ci00022a014

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

A new metabolism program, META, is introduced. In this paper, the basic principles on which the program operates are described. META is an expert system, capable of predicting the sites of potential enzymatic attack and the nature of the chemicals formed by such metabolic transformations. It operates from dictionaries of transformation operators, created by experts to represent known metabolic paths.

引用

页码：1320 / 1325

页数：6

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