OPTIMIZED INTERMOLECULAR POTENTIAL FUNCTIONS FOR AMIDES AND PEPTIDES - STRUCTURE AND PROPERTIES OF LIQUID AMIDES

被引:410
作者
JORGENSEN, WL
SWENSON, CJ
机构
关键词
D O I
10.1021/ja00289a008
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:569 / 578
页数:10
相关论文
共 72 条
[1]  
ALAGONA G, 1973, INT J PEPT PROT RES, V5, P251
[2]   NMR EVIDENCE FOR CIS- TRANS ISOMERISM IN N-METHYLACETAMIDE [J].
BARKER, RH ;
BOUDREAU.GJ .
SPECTROCHIMICA ACTA PART A-MOLECULAR SPECTROSCOPY, 1967, A 23 (03) :727-&
[3]  
BENEDETTI E, 1977, 5TH P AM PEPT S, P257
[4]  
Benson S.W., 1976, THERMOCHEMICAL KINET, Vsecond
[5]   AB-INITIO STUDIES OF HYDROGEN-BONDING BETWEEN PEPTIDE UNITS .4. MUTUAL ORIENTATIONS OF PEPTIDE PLANES [J].
BERTHOD, H ;
PULLMAN, A .
CHEMICAL PHYSICS LETTERS, 1972, 14 (02) :217-&
[6]   NMR RELAXATION STUDIES OF SOLUTE-SOLVENT INTERACTIONS [J].
BRYANT, RG .
ANNUAL REVIEW OF PHYSICAL CHEMISTRY, 1978, 29 :167-188
[7]   ENERGY COMPONENT ANALYSIS FOR DILUTE AQUEOUS-SOLUTIONS OF LI+, NA+, F-, AND CL- IONS [J].
CHANDRASEKHAR, J ;
SPELLMEYER, DC ;
JORGENSEN, WL .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1984, 106 (04) :903-910
[8]   ANALYTICAL POTENTIALS FROM ABINITIO COMPUTATIONS FOR INTERACTION BETWEEN BIOMOLECULES .1. WATER WITH AMINO-ACIDS [J].
CLEMENTI, E ;
CAVALLONE, F ;
SCORDAMAGLIA, R .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (17) :5531-5545
[9]   SIMULATIONS OF THE SOLVENT STRUCTURE FOR MACROMOLECULES .1. SOLVATION OF B-DNA DOUBLE HELIX AT T = 300 K [J].
CORONGIU, G ;
CLEMENTI, E .
BIOPOLYMERS, 1981, 20 (03) :551-571
[10]  
CORONGIU G, 1982, BIOPOLYMERS, V21, P763