QSAR modeling on binding affinity of diverse estrogenic flavonoids: Electronic, topological and spatial functions in quantitative approximation

Journal of Molecular Structure: THEOCHEM

Volumn 715, Issue 1-3, 2005, Pages 85-90

  Mukherjee, Subhendu ^a   Mukherjee, Arup ^a   Saha, Achintya ^a  

^a UNIVERSITY OF CALCUTTA   (India)

Author keywords

E state index; Flavonoids; Partial charge; Principal moment of inertia; Receptor binding affinity

Indexed keywords

3' HYDROXYFLAVONONE; 3',4',7 TRIHYDROXYISOFLAVONE; 3,6,4' TRIHYDROXYFLAVONE; 4' HYDROXYFLAVONONE; 4',6 DIHYDROXYFLAVONE; 6 HYDROXYFLAVONE; 6 HYDROXYFLAVONONE; 7 HYDROXYFLAVONONE; APIGENIN; BAICALEIN; BENZENE DERIVATIVE; BIOCHANIN A; DAIDZEIN; ESTROGEN RECEPTOR; FISETIN; FLAVONE DERIVATIVE; FORMONONETIN; GENISTEIN; KAEMPFEROL; MORIN; MYRICETIN; NARINGENIN; PHYTOESTROGEN; PRUNETIN; RUTOSIDE; UNCLASSIFIED DRUG;

ARTICLE; ATOM; BINDING AFFINITY; CARDIOVASCULAR RISK; DRUG CONFORMATION; DRUG PROTEIN BINDING; DRUG RECEPTOR BINDING; ESTROGEN ACTIVITY; EXPERIMENTAL MODEL; LINEAR REGRESSION ANALYSIS; PARAMETER; PHARMACOPHORE; QUANTITATIVE ANALYSIS; QUANTITATIVE STRUCTURE ACTIVITY RELATION; STATISTICAL SIGNIFICANCE; SUBSTITUTION REACTION; VARIANCE;

EID: 14044268048     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2004.10.061     Document Type: Article

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