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Volumn 101, Issue 11, 1997, Pages 2054-2060

Monte Carlo study of the effect of pressure on hydrophobic association

Author keywords

[No Author keywords available]

Indexed keywords

ASSOCIATION REACTIONS; CARBOXYLIC ACIDS; COMPRESSIBILITY OF LIQUIDS; COMPUTER SIMULATION; DISSOCIATION; FREE ENERGY; MONTE CARLO METHODS; PRESSURE EFFECTS;

EID: 0031097214     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp962977p     Document Type: Article
Times cited : (66)

References (66)
  • 4
    • 36849150819 scopus 로고
    • Kauzmann, W. Nature 1987, 325, 763-764.
    • (1987) Nature , vol.325 , pp. 763-764
    • Kauzmann, W.1
  • 21
    • 5544301107 scopus 로고    scopus 로고
    • note
    • Note that the definition of the partial molar compressibility given in eq 9 is different from the one given in our previous paper [15], In the latter, the translational contribution is excluded from the outset. The relationship between these two definitions is given in the appendix of [15].
  • 25
    • 5544254953 scopus 로고    scopus 로고
    • note
    • It should be noted that the standard tables are calibrated for pure water and not for mixtures of water and Hydrophobic solutes. Although the molar concentration of solute is small in these simulations, there may be an effect on the calibration of the density with pressure. This would affect the results quantitatively, but the qualitative conclusions would remain the same.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.