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
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
收藏
页码:424 / 440
页数:17
相关论文
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