ELECTROSTATIC INTERACTIONS IN MOLECULAR MECHANICS (MM2) CALCULATIONS VIA PEOE PARTIAL CHARGES .1. HALOALKANES

被引：42

作者：

HAMMARSTROM, LG

LILJEFORS, T

GASTEIGER, J

机构：

[1] UNIV LUND,CTR CHEM,DEPT ORGAN CHEM,S-22100 LUND,SWEDEN

[2] TECH UNIV MUNICH,INST INSERM,D-8046 GARCHING,FED REP GER

来源：

JOURNAL OF COMPUTATIONAL CHEMISTRY | 1988年 / 9卷 / 04期

关键词：

D O I：

10.1002/jcc.540090418

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：424 / 440

页数：17

共 111 条

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