A partition coefficient calculation method with the SFED model

Journal of Chemical Information and Modeling

Volumn 45, Issue 2, 2005, Pages 254-263

  In, Youngyong ^a,b   Chai, Han Ha ^b   No, Kyoung Tai ^a,c  

^a Bioinformatics and Molecular Design Research Center (BMDRC)   (South Korea)

^b Soongsil University   (South Korea)

^c Yonsei University   (South Korea)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION; HYDRATION; METABOLITES; OPTIMIZATION; SOLVENTS;

BINARY SOLVENTS; HYDRATION FREE ENERGY DENSITY (HFED); QUANTITATIVE STRUCTURE ACTIVITY RELATIONSHIP (QSAR); SOLVATION FREE ENERGY DENSITY (SFED);

FREE ENERGY;

OCTANOL; SOLVENT; WATER;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; METHODOLOGY; SOLUBILITY; THERMODYNAMICS;

1-OCTANOL; MODELS, CHEMICAL; RESEARCH DESIGN; SOLUBILITY; SOLVENTS; THERMODYNAMICS; WATER;

EID: 18344371385     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci0498564     Document Type: Article

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