Compass: Predicting Biological Activities from Molecular Surface Properties. Performance Comparisons on a Steroid Benchmark

Journal of Medicinal Chemistry

Volumn 37, Issue 15, 1994, Pages 2315-2327

  Jain, Ajay N ^a   Koile, Kimberle ^a,b   Chapman, David ^a  

^a Arris Pharmaceutical Corporation   (United States)

^b MASSACHUSETTS INSTITUTE OF TECHNOLOGY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

SEX HORMONE BINDING GLOBULIN; STEROID; TRANSCORTIN;

ACCURACY; ALGORITHM; ARTICLE; BINDING AFFINITY; DRUG ACTIVITY; DRUG CONFORMATION; INTERMETHOD COMPARISON; MOLECULAR INTERACTION; PROTEIN BINDING; QUANTITATIVE STRUCTURE ACTIVITY RELATION;

ALGORITHMS; COMPARATIVE STUDY; MODELS, MOLECULAR; MODELS, STATISTICAL; MOLECULAR CONFORMATION; SEX HORMONE-BINDING GLOBULIN; STEROIDS; STRUCTURE-ACTIVITY RELATIONSHIP; SUPPORT, NON-U.S. GOV'T; SURFACE PROPERTIES; TRANSCORTIN;

EID: 0027930292     PISSN: 00222623     EISSN: 15204804     Source Type: Journal    
DOI: 10.1021/jm00041a010     Document Type: Article

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