CRITICAL EVALUATION OF MOLECULAR MECHANICS

被引：879

作者：

ENGLER, EM ^{[1
]}

ANDOSE, JD ^{[1
]}

SCHLEYER, PV ^{[1
]}

机构：

[1] PRINCETON UNIV, DEPT CHEM, PRINCETON, NJ 08540 USA

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1973年 / 95卷 / 24期

关键词：

D O I：

10.1021/ja00805a012

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：8005 / 8025

页数：21

共 79 条

[51] MOLECULAR GEOMETRY .V. EVALUATION OF FUNCTIONS AND CONFORMATIONS OF MEDIUM RINGS [J].

HENDRICKSON, JB .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1967, 89 (26) :7036-+

[52] MOLECULAR GEOMETRY .6. METHYL-SUBSTITUED CYCLOALKANES [J].

HENDRICKSON, JB .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1967, 89 (26) :7043-+

[53]

HOOKE R, 1961, J ACM, V8, P212, DOI 10.1145/321062.321069

[54] INFLUENCE OF NONBONDED INTERACTIONS ON MOLECULAR GEOMETRY AND ENERGY - CALCULATION FOR HYDROCARBONS BASED ON UREY-BRADLEY FIELD [J].

JACOB, EJ ;

THOMPSON, HB ;

BARTELL, LS .

JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (10) :3736-&

[55]

KARIM A, 1971, TETRAHEDRON LETT, P3987

[56]

KARPETYANTS MK, 1970, HDB THERMODYNAMIC CO

[57]

Klopman G., 1970, FORTSCHR CHEM FORSCH, V15, P445

[58] CONSISTENT FORCE FIELD FOR CALCULATIONS OF CONFORMATIONS VIBRATIONAL SPECTRA AND ENTHALPIES OF CYCLOALKANE AND N-ALKANE MOLECULES [J].

LIFSON, S ;

WARSHEL, A .

JOURNAL OF CHEMICAL PHYSICS, 1968, 49 (11) :5116-&

[59]

LIFSON S, PRIVATE COMMUNICATIO

[60]

OUELLETTE RJ, 1972, 164 NAT M AM CHEM SO

← 1 2 3 4 5 6 7 8 →