Detailed analysis of scoring functions for virtual screening

Journal of Medicinal Chemistry

Volumn 44, Issue 7, 2001, Pages 1035-1042

  Stahl, M ^a   Rarey, M ^b  

^a F HOFFMANN LA ROCHE LTD   (Switzerland)

^b FRAUNHOFER INSTITUTE FOR ALGORITHMS AND SCIENTIFIC COMPUTING SCAI   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CYCLOOXYGENASE 2; CYCLOOXYGENASE 2 INHIBITOR; DNA TOPOISOMERASE (ATP HYDROLYSING); ESTROGEN RECEPTOR; ESTROGEN RECEPTOR BLOCKING AGENT; ESTROGEN RECEPTOR STIMULATING AGENT; GELATINASE A; HORMONE RECEPTOR BLOCKING AGENT; HORMONE RECEPTOR STIMULATING AGENT; MATRIX METALLOPROTEINASE; MITOGEN ACTIVATED PROTEIN KINASE; MITOGEN ACTIVATED PROTEIN KINASE INHIBITOR; SIALIDASE; THROMBIN; THROMBIN INHIBITOR; UNCLASSIFIED DRUG;

ACCURACY; ANALYTIC METHOD; ARTICLE; BINDING SITE; CALCULATION; COMPUTER PROGRAM; CONTROLLED STUDY; DRUG ACTIVITY; DRUG PROTEIN BINDING; DRUG SCREENING; DRUG STRUCTURE; INTERMETHOD COMPARISON; MOLECULAR WEIGHT; PROTEIN STRUCTURE; SCORING SYSTEM; STRUCTURE ACTIVITY RELATION;

DATABASES, FACTUAL; LIGANDS; MODELS, MOLECULAR; PROTEIN BINDING; SOFTWARE;

EID: 0035966871     PISSN: 00222623     EISSN: None     Source Type: Journal    
DOI: 10.1021/jm0003992     Document Type: Article

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