ENERGY PARAMETERS IN POLYPEPTIDES .2. SEMIEMPIRICAL MOLECULAR ORBITAL CALCULATIONS FOR MODEL PEPTIDES

被引：211
作者：
YAN, JF
MOMANY, FA
HOFFMANN, R
SCHERAGA, HA
机构：
来源：
JOURNAL OF PHYSICAL CHEMISTRY | 1970年 / 74卷 / 02期
关键词：
D O I：
10.1021/j100697a031
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：
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页码：420 / &
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[21]  
GO N, IN PRESS
[22]   MICROWAVE SPECTRUM OF PROPYLENE .2. POTENTIAL FUNCTION FOR INTERNAL ROTATION OF METHYL GROUP [J].
HIROTA, E .
JOURNAL OF CHEMICAL PHYSICS, 1966, 45 (06) :1984-&
[23]   EXTENDED HUCKEL THEORY .4. CARBONIUM IONS [J].
HOFFMAN, R .
JOURNAL OF CHEMICAL PHYSICS, 1964, 40 (09) :2480-&
[24]   EXTENDED HUCKEL THEORY .3. COMPOUNDS OF BORON + NITROGEN [J].
HOFFMAN, R .
JOURNAL OF CHEMICAL PHYSICS, 1964, 40 (09) :2474-&
[25]   AN EXTENDED HUCKEL THEORY .I. HYDROCARBONS [J].
HOFFMANN, R .
JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (06) :1397-&
[26]   DEPENDENCE OF CONFORMATIONAL AND ISOMER STABILITY ON NUMBER OF ELECTRONS IN EXTENDED PI SYSTEMS [J].
HOFFMANN, R ;
OLOFSON, RA .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1966, 88 (05) :943-&
[27]   EXTENDED HUCKEL THEORY .2. SIGMA ORBITALS IN AZINES [J].
HOFFMANN, R .
JOURNAL OF CHEMICAL PHYSICS, 1964, 40 (09) :2745-&
[28]  
HOFFMANN R, EXTHUC EXTENDED HUCK
[29]   SPECTRA OF SIMPLE AMIDES IN THE VACUUM ULTRAVIOLET [J].
HUNT, HD ;
SIMPSON, WT .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1953, 75 (18) :4540-4543
[30]   CALCULATION OF ENERGY LEVELS FOR INTERNAL TORSION AND OVER-ALL ROTATION .2. CH3CHO TYPE MOLECULES - ACETALDEHYDE SPECTRA [J].
KILB, RW ;
LIN, CC ;
WILSON, EB .
JOURNAL OF CHEMICAL PHYSICS, 1957, 26 (06) :1695-1703
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