THE CALCULATION OF MOLECULAR ELECTROSTATIC POTENTIAL FROM A MULTIPOLE EXPANSION BASED ON LOCALIZED ORBITALS AND DEVELOPED AT THEIR CENTROIDS - ACCURACY AND APPLICABILITY FOR MACROMOLECULAR COMPUTATIONS

被引：19

作者：

ETCHEBEST, C

LAVERY, R

PULLMAN, A

机构：

来源：

THEORETICA CHIMICA ACTA | 1982年 / 62卷 / 01期

关键词：

D O I：

10.1007/BF00551050

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

引用

页码：17 / 28

页数：12

共 18 条

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