Molecular property eXplorer: A novel approach to visualizing SAR using tree-maps and heatmaps

Journal of Chemical Information and Modeling

Volumn 45, Issue 2, 2005, Pages 523-532

  Kibbey, Christopher ^a   Calvet, Alain ^a  

^a PFIZER INC   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALGORITHMS; BINDING ENERGY; COMPUTER AIDED SOFTWARE ENGINEERING; DRUG PRODUCTS; HIERARCHICAL SYSTEMS; PRINCIPAL COMPONENT ANALYSIS; SCREENING; STRUCTURE (COMPOSITION); VISUALIZATION;

HEATMAPS; MOLECULAR PROPERTY EXPLORER (MPX); MULTIDIMENSIONAL SCALING (MDS); TREE-MAPS;

SOFTWARE ENGINEERING;

ESTROGEN RECEPTOR; FLAVONE DERIVATIVE; PHYTOESTROGEN;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; CLUSTER ANALYSIS; COMPUTER PROGRAM; COMPUTER SIMULATION; HEAT; METABOLISM; STRUCTURE ACTIVITY RELATION;

CLUSTER ANALYSIS; COMPUTER SIMULATION; FLAVONES; HEAT; MODELS, CHEMICAL; MOLECULAR STRUCTURE; PHYTOESTROGENS; RECEPTORS, ESTROGEN; SOFTWARE; STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 18344374398     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci0496954     Document Type: Article

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