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  • Modeling Free Energies of Solvation in Olive Oil
    [作者:Chamberlin, AC; Levitt, DG; Cramer, CJ; Truhlar, DG,期刊:Molecular Pharmaceutics, 页码:1064-1079 , 文章类型: Review,,卷期:2008年5-6]
  • Olive oil partition coefficients are useful for modeling the bioavailability of drug-like compounds. We have recently developed an accurate solvation model called SM8 for aqueous and organic solvents (Marenich, A. V.; Ol...