GROUP GROUP BOND INDEX FOR MOLECULAR-SYSTEMS

被引:13
作者
GIAMBIAGI, M [1 ]
DEGIAMBIAGI, MS [1 ]
MUNDIM, KC [1 ]
机构
[1] UNIV FED BAHIA,INST FIS,BR-40210 SALVADOR,BA,BRAZIL
来源
JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS | 1992年 / 88卷 / 20期
关键词
D O I
10.1039/ft9928802995
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
The previous definition of a bond index between two atoms within a molecular framework is extended so as to represent a group-group bond index. The present index gives an adequate account of hydrogen-bonded nucleotide base dimers and unusual weakly bonded associations. A single number may thus render a reasonable qualitative idea of intra- and inter-molecular binding. The index leads to a definition of molecular valence.
引用
收藏
页码:2995 / 2999
页数:5
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