ENERGY PARAMETERS IN POLYPEPTIDES .5. EMPIRICAL HYDROGEN-BOND POTENTIAL FUNCTION BASED ON MOLECULAR-ORBITAL CALCULATIONS

被引：173
作者：
MCGUIRE, RF
SCHERAGA, HA
MOMANY, FA
机构：
来源：
JOURNAL OF PHYSICAL CHEMISTRY | 1972年 / 76卷 / 03期
关键词：
D O I：
10.1021/j100647a017
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：375 / &
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共 41 条
[1]   A REINVESTIGATION OF STRUCTURE OF MONOMER AND DIMER FORMIC ACID BY GAS ELECTRON DIFFRACTION TECHNIQUE [J].
ALMENNINGEN, A ;
BASTIANSEN, O ;
MOTZFELDT, T .
ACTA CHEMICA SCANDINAVICA, 1969, 23 (08) :2848-+
[2]  
[Anonymous], 1968, ADV PHYS ORG CHEM
[3]   POTENTIAL FUNCTIONS FOR HYDROGEN BOND INTERACTIONS .2. FORMULATION OF AN EMPIRICAL POTENTIAL FUNCTION [J].
BALASUBR.R ;
CHIDAMBA.R ;
RAMACHAN.GN .
BIOCHIMICA ET BIOPHYSICA ACTA, 1970, 221 (02) :196-&
[4]  
BRATOZ S, 1967, ADV QUANTUM CHEM, V3, P209
[5]   STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .12. HYDROGEN BRIDGES IN GUANINE-CYTOSINE PAIR AND IN DIMERIC FORM OF FORMIC ACID [J].
CLEMENTI, E ;
MEHL, J ;
VONNIESS.W .
JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (02) :508-&
[6]  
COULSON CA, 1971, VALENCE, P197
[7]   Intermolecular energies of small water polymers [J].
Del Bene, Janet ;
Pople, J. A. .
CHEMICAL PHYSICS LETTERS, 1969, 4 (07) :426-428
[8]   REINVESTIGATION OF MOLECULAR STRUCTURE OF ACETIC ACID MONOMER AND DIMER BY GAS ELECTRON DIFFRACTION [J].
DERISSEN, JL .
JOURNAL OF MOLECULAR STRUCTURE, 1971, 7 (1-2) :67-&
[9]   INVESTIGATION OF STRUCTURE OF PROPIONIC ACID MONOMER AND DIMER BY GAS ELECTRON DIFFRACTION [J].
DERISSEN, JL .
JOURNAL OF MOLECULAR STRUCTURE, 1971, 7 (1-2) :81-&
[10]  
HAMILTON WC, 1968, HYDROGEN BONDING SOL, P53
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