AN APPRAISAL OF MOLECULAR-FORCE FIELDS FOR THE REPRESENTATION OF POLYPEPTIDES

被引:55
作者
HALL, D
PAVITT, N
机构
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D O I
10.1002/jcc.540050504
中图分类号
O6 [化学];
学科分类号
0703 ;
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页码:441 / 450
页数:10
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共 40 条
[1]  
BEAGLEY B, 1978, MOL STRUCTURE DIFFRA, V6, P63
[2]  
Berendsen H. J. C., 1981, INTERMOLECULAR FORCE, P331, DOI [DOI 10.1007/978-94-015-7658-1_21, DOI 10.1007/978-94-015-7658-1-21]
[3]  
BLANEY JM, 1982, J AM CHEM SOC, V104, P6244
[4]   DYNAMICS OF LIGAND-BINDING TO HEME-PROTEINS [J].
CASE, DA ;
KARPLUS, M .
JOURNAL OF MOLECULAR BIOLOGY, 1979, 132 (03) :343-368
[5]   ENERGY PARAMETERS IN POLYPEPTIDES .8. EMPIRICAL POTENTIAL-ENERGY ALGORITHM FOR CONFORMATIONAL-ANALYSIS OF LARGE MOLECULES [J].
DUNFIELD, LG ;
BURGESS, AW ;
SCHERAGA, HA .
JOURNAL OF PHYSICAL CHEMISTRY, 1978, 82 (24) :2609-2616
[6]   CRITICAL EVALUATION OF MOLECULAR MECHANICS [J].
ENGLER, EM ;
ANDOSE, JD ;
SCHLEYER, PV .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1973, 95 (24) :8005-8025
[7]   SIDE-CHAIN TORSIONAL POTENTIALS - EFFECT OF DIPEPTIDE, PROTEIN, AND SOLVENT ENVIRONMENT [J].
GELIN, BR ;
KARPLUS, M .
BIOCHEMISTRY, 1979, 18 (07) :1256-1268
[8]   CALCULATION OF CONFORMATION OF CYCLO-HEXAGLYCYL .2. APPLICATION OF A MONTE-CARLO METHOD [J].
GO, N ;
SCHERAGA, HA .
MACROMOLECULES, 1978, 11 (03) :552-559
[9]   CALCULATION OF CONFORMATION OF CYCLO-HEXAGLYCYL [J].
GO, N ;
SCHERAGA, HA .
MACROMOLECULES, 1973, 6 (04) :525-535
[10]   MONTE-CARLO COMPUTER-SIMULATION OF WATER AMINO-ACID INTERACTIONS [J].
GOODFELLOW, JM ;
FINNEY, JL ;
BARNES, P .
PROCEEDINGS OF THE ROYAL SOCIETY SERIES B-BIOLOGICAL SCIENCES, 1982, 214 (1195) :213-228