Henry's law constant of hydrocarbons in air-water system: The cavity ovality effect on the non-electrostatic contribution term of solvation free energy

SAR and QSAR in Environmental Research

Volumn 16, Issue 5, 2005, Pages 461-482

  Modarresi, H ^a   Modarress, H ^a   Dearden, J C ^b  

^a AMIRKABIR UNIVERSITY OF TECHNOLOGY   (Iran)

^b LIVERPOOL JOHN MOORES UNIVERSITY   (United Kingdom)

Author keywords

Cavity ovality; Henry's law constant; QSPR; Solvation free energy; Solvent accessible surface area

Indexed keywords

AIR; FREE ENERGY; HYDROCARBONS; REGRESSION ANALYSIS; SOLVATION; SOLVENTS; WATER MANAGEMENT; WATERWORKS;

AIR-WATER SYSTEM; ALIPHATIC HYDROCARBONS; CAVITY OVALITY; DESCRIPTORS; HENRY'S LAW CONSTANT; OVALITY; QUANTITATIVE STRUCTURE PROPERTY RELATIONSHIPS; ROOT MEAN SQUARE ERRORS; SOLVATION FREE ENERGIES; SOLVENT-ACCESSIBLE SURFACE AREA;

MEAN SQUARE ERROR;

EID: 30944432768     PISSN: 1062936X     EISSN: 1029046X     Source Type: Journal    
DOI: 10.1080/10659360500319869     Document Type: Article

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