Evaluation of the molecular configuration integral in all degrees of freedom for the direct calculation of binding free energies: Application to the enantioselective binding of amino acid derivatives to synthetic host molecules

Journal of the American Chemical Society

Volumn 119, Issue 42, 1997, Pages 10233-10234

  Kolossvary, I ^a  

^a Columbia University ^*  (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AMINO ACID DERIVATIVE;

ARTICLE; CALCULATION; CONFORMATION; ENERGY; MODEL; SOLVATION; TECHNIQUE; THERMODYNAMICS;

EID: 0030694573     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja971573n     Document Type: Article

References (17)