DYNAMICS AND DESIGN OF ENZYMES AND INHIBITORS

被引：257
作者：
WONG, CF [1 ]
MCCAMMON, JA [1 ]
机构：
[1] UNIV HOUSTON, DEPT CHEM, HOUSTON, TX 77004 USA
来源：
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1986年 / 108卷 / 13期
关键词：
D O I：
10.1021/ja00273a048
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
引用
收藏
页码：3830 / 3832
页数：3
相关论文
共 22 条
[1]   DESIGNING DRUGS TO FIT A MACROMOLECULAR RECEPTOR [J].
BEDDELL, CR .
CHEMICAL SOCIETY REVIEWS, 1984, 13 (03) :279-319
[2]   MOLECULAR-DYNAMICS WITH COUPLING TO AN EXTERNAL BATH [J].
BERENDSEN, HJC ;
POSTMA, JPM ;
VANGUNSTEREN, WF ;
DINOLA, A ;
HAAK, JR .
JOURNAL OF CHEMICAL PHYSICS, 1984, 81 (08) :3684-3690
[3]   PROTEIN DATA BANK - COMPUTER-BASED ARCHIVAL FILE FOR MACROMOLECULAR STRUCTURES [J].
BERNSTEIN, FC ;
KOETZLE, TF ;
WILLIAMS, GJB ;
MEYER, EF ;
BRICE, MD ;
RODGERS, JR ;
KENNARD, O ;
SHIMANOUCHI, T ;
TASUMI, M .
JOURNAL OF MOLECULAR BIOLOGY, 1977, 112 (03) :535-542
[4]   REFINED CRYSTAL-STRUCTURE OF BOVINE BETA-TRYPSIN AT 1.8 A RESOLUTION .2. CRYSTALLOGRAPHIC REFINEMENT, CALCIUM-BINDING SITE, BENZAMIDINE BINDING-SITE AND ACTIVE-SITE AT PH 7.0 [J].
BODE, W ;
SCHWAGER, P .
JOURNAL OF MOLECULAR BIOLOGY, 1975, 98 (04) :693-717
[5]   REDESIGNING TRYPSIN - ALTERATION OF SUBSTRATE-SPECIFICITY [J].
CRAIK, CS ;
LARGMAN, C ;
FLETCHER, T ;
ROCZNIAK, S ;
BARR, PJ ;
FLETTERICK, R ;
RUTTER, WJ .
SCIENCE, 1985, 228 (4697) :291-297
[6]  
CRAIK CS, 1984, J BIOL CHEM, V259, P4255
[7]  
FRIEDMAN HL, 1985, COURSE STATISTICAL M
[8]   A CONSISTENT EMPIRICAL POTENTIAL FOR WATER-PROTEIN INTERACTIONS [J].
HERMANS, J ;
BERENDSEN, HJC ;
VANGUNSTEREN, WF ;
POSTMA, JPM .
BIOPOLYMERS, 1984, 23 (08) :1513-1518
[9]   MONTE-CARLO SIMULATION OF DIFFERENCES IN FREE-ENERGIES OF HYDRATION [J].
JORGENSEN, WL ;
RAVIMOHAN, C .
JOURNAL OF CHEMICAL PHYSICS, 1985, 83 (06) :3050-3054
[10]   THEORY OF COMPLEX MOLECULAR-INTERACTIONS - COMPUTER-GRAPHICS, DISTANCE GEOMETRY, MOLECULAR MECHANICS, AND QUANTUM-MECHANICS [J].
KOLLMAN, P .
ACCOUNTS OF CHEMICAL RESEARCH, 1985, 18 (04) :105-111
123