FREE-ENERGY SIMULATIONS - APPLICATIONS TO THE STUDY OF LIQUID WATER, HYDROPHOBIC INTERACTIONS AND SOLVENT EFFECTS ON CONFORMATIONAL STABILITY

被引：9

作者：

BEVERIDGE, DL

MEZEI, M

RAVISHANKER, G

JAYARAM, B

机构：

来源：

JOURNAL OF BIOSCIENCES | 1985年 / 8卷 / 1-2期

关键词：

D O I：

10.1007/BF02703974

中图分类号：

Q [生物科学];

学科分类号：

07 ; 0710 ; 09 ;

摘要：

引用

页码：167 / 178

页数：12

共 57 条

[41] MONTE-CARLO METHOD FOR OBTAINING INTERIONIC POTENTIAL OF MEAN FORCE IN IONIC SOLUTION [J].

PATEY, GN ;

VALLEAU, JP .

JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (06) :2334-2339

[42]

POSTLER JL, 1982, OHIO J SCI, V82, P55

[43] NON-DESTRUCTIVE MOLECULAR-DYNAMICS SIMULATION OF THE CHEMICAL-POTENTIAL OF A FLUID [J].

POWLES, JG ;

EVANS, WAB ;

QUIRKE, N .

MOLECULAR PHYSICS, 1982, 46 (06) :1347-1370

[44] THEORY OF HYDROPHOBIC EFFECT [J].

PRATT, LR ;

CHANDLER, D .

JOURNAL OF CHEMICAL PHYSICS, 1977, 67 (08) :3683-3704

[45] ENERGY DIFFERENCE FUNCTIONS IN MONTE-CARLO SIMULATIONS - APPLICATION TO (1) THE CALCULATION OF THE FREE-ENERGY OF LIQUID-NITROGEN, (2) THE FLUCTUATION OF MONTE-CARLO AVERAGES [J].

QUIRKE, N ;

JACUCCI, G .

MOLECULAR PHYSICS, 1982, 45 (04) :823-838

[46] POTENTIAL OF MEAN FORCE FOR THE STACKING OF PHENYL RINGS IN AQUEOUS-SOLUTION [J].

RAVISHANKER, G ;

BEVERIDGE, DL .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1985, 107 (08) :2565-2566

[47]

RAVISHANKER G, 1982, FARADAY S CHEM SOC, V17, P79

[48] MOLECULAR-DYNAMICS AND MONTE-CARLO STUDY OF SOLVENT EFFECTS ON THE CONFORMATIONAL EQUILIBRIUM OF N-BUTANE IN CCL4 [J].

REBERTUS, DW ;

BERNE, BJ ;

CHANDLER, D .

JOURNAL OF CHEMICAL PHYSICS, 1979, 70 (07) :3395-3400

[49] CALCULATION OF THE ENTROPY OF LIQUID CHLORINE AND BROMINE BY COMPUTER-SIMULATION [J].

ROMANO, S ;

SINGER, K .

MOLECULAR PHYSICS, 1979, 37 (06) :1765-1772

[50] THERMODYNAMICS AND STRUCTURE OF LIQUID WATER - MONTE-CARLO METHOD [J].

SARKISOV, GN ;

DASHEVSKY, VG ;

MALENKOV, GG .

MOLECULAR PHYSICS, 1974, 27 (05) :1249-1269

← 1 2 3 4 5 6 →