A new method for predicting binding free energy between receptor and ligand

Proteins: Structure, Function and Genetics

Volumn 33, Issue 1, 1998, Pages 62-73

  Takamatsu, Yoshihiro ^a   Itai, Akiko ^a,b  

^a UNIVERSITY OF TOKYO   (Japan)

^b Inst of Medicinal Molecular Design   (Japan)

Author keywords

Computer simulation; Desolvation energy; Drug design; Receptor ligand interaction; Solvation energy

Indexed keywords

ARTICLE; COMPUTER SIMULATION; DRUG DESIGN; DRUG RECEPTOR BINDING; ENERGY METABOLISM; MATHEMATICAL ANALYSIS; MOLECULAR INTERACTION; PRIORITY JOURNAL; RECEPTOR AFFINITY;

EID: 0032189864     PISSN: 08873585     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1097-0134(19981001)33:1<62::AID-PROT6>3.0.CO;2-N     Document Type: Article

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