CALCULATION OF MOLECULAR VOLUMES FROM MOLECULAR FRAGMENTS VIA VALENCE ELECTRON INDEXES

被引:6
作者
GOVERS, H
DEVOOGT, P
机构
来源
QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS | 1989年 / 8卷 / 01期
关键词
D O I
10.1002/qsar.19890080103
中图分类号
R914 [药物化学];
学科分类号
100701 ;
摘要
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页码:11 / 16
页数:6
相关论文
共 15 条
[1]   VAN DER WAALS VOLUMES + RADII [J].
BONDI, A .
JOURNAL OF PHYSICAL CHEMISTRY, 1964, 68 (03) :441-+
[2]  
BONDI A, 1968, PHYSICAL PROPERTIES
[3]  
COULSON CA, 1965, VALENCE, P28
[4]  
GOODISMAN J, 1977, CONT QANTUM CHEM, P8
[5]   QUANTITATIVE STRUCTURE ACTIVITY RELATIONSHIPS FOR POLYCYCLIC AROMATIC-HYDROCARBONS - CORRELATION BETWEEN MOLECULAR CONNECTIVITY, PHYSICOCHEMICAL PROPERTIES, BIOCONCENTRATION AND TOXICITY IN DAPHNIA-PULEX [J].
GOVERS, H ;
RUEPERT, C ;
AIKING, H .
CHEMOSPHERE, 1984, 13 (02) :227-236
[6]  
GOVERS H, 1986, ORGANIC MICROPOLLUTA, P475
[7]  
KETELAAR JAA, 1960, CHEM CONSTITUTION, P149
[8]   DERIVATION AND SIGNIFICANCE OF VALENCE MOLECULAR CONNECTIVITY [J].
KIER, LB ;
HALL, LH .
JOURNAL OF PHARMACEUTICAL SCIENCES, 1981, 70 (06) :583-589
[9]   GENERAL DEFINITION OF VALENCE DELTA-VALUES FOR MOLECULAR CONNECTIVITY [J].
KIER, LB ;
HALL, LH .
JOURNAL OF PHARMACEUTICAL SCIENCES, 1983, 72 (10) :1170-1173
[10]   INTERPRETATION OF PROTEIN STRUCTURES - ESTIMATION OF STATIC ACCESSIBILITY [J].
LEE, B ;
RICHARDS, FM .
JOURNAL OF MOLECULAR BIOLOGY, 1971, 55 (03) :379-&