Inferring the hydrophobic interaction from the properties of neat water

被引：55

作者：

Berne, BJ

机构：

来源：

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA | 1996年 / 93卷 / 17期

关键词：

MONTE-CARLO SIMULATION; MOLECULAR-DYNAMICS; COMPUTER-SIMULATIONS; N-BUTANE; HYDRATION; LIQUIDS;

D O I：

10.1073/pnas.93.17.8800

中图分类号：

O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];

学科分类号：

07 ; 0710 ; 09 ;

摘要：

引用

页码：8800 / 8803

页数：4

共 26 条

[1]

Allen M. P., 2017, COMPUTER SIMULATION

[2] FINITE REPRESENTATION OF AN INFINITE BULK SYSTEM - SOLVENT BOUNDARY POTENTIAL FOR COMPUTER-SIMULATIONS [J].

BEGLOV, D ;

ROUX, B .

JOURNAL OF CHEMICAL PHYSICS, 1994, 100 (12) :9050-9063

[3]

Berne B. J., 1970, Advances in chemical physics vol. 18, P63, DOI 10.1002/9780470143636.ch3

[4] GAUSSIAN FIELD MODEL OF FLUIDS WITH AN APPLICATION TO POLYMERIC FLUIDS [J].

CHANDLER, D .

PHYSICAL REVIEW E, 1993, 48 (04) :2898-2905

[5]

Chandler D., 1987, Introduction to modern statistical mechanics

[6] LINEAR AND ANGULAR-MOMENTUM AUTOCORRELATION FUNCTIONS IN DIATOMIC LIQUIDS [J].

HARP, GD ;

BERNE, BJ .

JOURNAL OF CHEMICAL PHYSICS, 1968, 49 (03) :1249-&

[7]

Hill L, 1987, Statistical Mechanics. Principles and Selected Applications

[8] An information theory model of hydrophobic interactions [J].

Hummer, G ;

Garde, S ;

Garcia, AE ;

Pohorille, A ;

Pratt, LR .

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 1996, 93 (17) :8951-8955

[9]

JAYNES ET, 1983, ET JAYNES PAPERS PRO, P315

[10] QUANTUM AND STATISTICAL MECHANICAL STUDIES OF LIQUIDS .29. MONTE-CARLO SIMULATION OF N-BUTANE IN WATER - CONFORMATIONAL EVIDENCE FOR THE HYDROPHOBIC EFFECT [J].

JORGENSEN, WL .

JOURNAL OF CHEMICAL PHYSICS, 1982, 77 (11) :5757-5765

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