THEORETICAL-STUDIES OF MOLECULAR-CONFORMATION .2. APPLICATION OF THE SIBFA PROCEDURE TO MOLECULES CONTAINING CARBONYL AND CARBOXYLATE OXYGENS AND AMIDE NITROGENS

被引：59

作者：

GRESH, N

PULLMAN, A

CLAVERIE, P

机构：

来源：

THEORETICA CHIMICA ACTA | 1985年 / 67卷 / 01期

关键词：

D O I：

10.1007/BF00555018

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：

引用

页码：11 / 32

页数：22

共 21 条

[1] INFRARED SPECTROSCOPY OF SOME MODEL PEPTIDE CONFORMATIONS [J].

AVIGNON, M ;

HUONG, PV ;

LASCOMBE, J ;

MARRAUD, M ;

NEEL, J .

BIOPOLYMERS, 1969, 8 (01) :69-&

[2] STABLE CONFORMATIONS OF DIPEPTIDES [J].

BURGESS, AW ;

SCHERAGA, HA .

BIOPOLYMERS, 1973, 12 (09) :2177-2183

[3] ATOMIC SCREENING CONSTANTS FROM SCF FUNCTIONS [J].

CLEMENTI, E ;

RAIMONDI, DL .

JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (11) :2686-&

[4]

CUNG M, 1973, CONFORMATION BIOL MO

[5] THE GRAMICIDIN-A CHANNEL - ROLE OF THE ETHANOLAMINE END CHAIN ON THE ENERGY PROFILE FOR SINGLE OCCUPANCY BY NA+ [J].

ETCHEBEST, C ;

PULLMAN, A .

FEBS LETTERS, 1984, 170 (01) :191-195

[6] THEORETICAL-STUDIES OF MOLECULAR-CONFORMATION - DERIVATION OF AN ADDITIVE PROCEDURE FOR THE COMPUTATION OF INTRAMOLECULAR INTERACTION ENERGIES - COMPARISON WITH ABINITIO SCF COMPUTATIONS [J].

GRESH, N ;

CLAVERIE, P ;

PULLMAN, A .

THEORETICA CHIMICA ACTA, 1984, 66 (01) :1-20

[7] Intermolecular Interactions: Reproduction of the Results of Ab initio Supermolecule Computations by an Additive Procedure [J].

Gresh, N. ;

Claverie, P. ;

Pullman, A. .

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1979, 16 :243-253

[8] A THEORETICAL-STUDY ON THE SPECIFICITY OF TETRAMETHYLAMMONIUM VERSUS MONOMETHYLAMMONIUM BINDING TO THE ACTIVE-SITE OF A PHOSPHORYLCHOLINE ANTIBODY [J].

GRESH, N ;

PULLMAN, B .

BIOCHIMICA ET BIOPHYSICA ACTA, 1980, 625 (02) :356-367

[9] EXPERIMENTAL AND THEORETICAL STUDIES OF BARRIER TO ROTATION ABOUT N-C-ALPHA AND C-ALPHA-C' BONDS (PHI AND PSI) IN AMIDES AND PEPTIDES [J].

HAGLER, AT ;

LEISEROWITZ, L ;

TUVAL, M .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1976, 98 (15) :4600-4612

[10] CONFORMATIONAL BEHAVIOR OF THE ARCHITECTURAL UNITS OF PEPTIDES AND PROTEINS - ASSESSMENT OF CURRENT UNDERSTANDING BY ABINITIO QUANTUM-MECHANICAL METHODS AND REFINEMENT OF THE DIPEPTIDE ENERGY SURFACE [J].

HILLIER, IH ;

ROBSON, B .

JOURNAL OF THEORETICAL BIOLOGY, 1979, 76 (01) :83-98

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