CoMSIA and docking study of rhenium based estrogen receptor ligand analogs

Steroids

Volumn 72, Issue 3, 2007, Pages 247-260

  Wolohan, Peter ^a   Reichert, David E ^a  

^a WASHINGTON UNIVERSITY SCHOOL OF MEDICINE   (United States)

Author keywords

CoMSIA; Docking; Estrogen receptor; Rhenium

Indexed keywords

CARBONYL DERIVATIVE; ESTRADIOL; ESTROGEN RECEPTOR; ESTROGEN RECEPTOR ALPHA; FURAN DERIVATIVE; LIGAND; ORGANIC COMPOUND; ORGANOMETALLIC COMPOUND; PYRAZOLE DERIVATIVE; RHENIUM COMPLEX;

ARTICLE; BINDING AFFINITY; BINDING SITE; CHEMICAL STRUCTURE; COMPARATIVE MOLECULAR SIMILARITY INDICES ANALYSIS; HYDROPHOBICITY; LIGAND BINDING; PARTIAL LEAST SQUARES REGRESSION; STEREOSPECIFICITY; VALIDATION PROCESS;

BINDING SITES; COMPUTER SIMULATION; ESTRADIOL; ESTROGEN RECEPTOR ALPHA; ESTROGEN RECEPTOR BETA; ESTROGENS; ESTROGENS, NON-STEROIDAL; IMAGING, THREE-DIMENSIONAL; LIGANDS; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR CONFORMATION; MOLECULAR STRUCTURE; ORGANOMETALLIC COMPOUNDS; PROTEIN BINDING; PYRAZOLES; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP; RECEPTORS, ESTROGEN; RHENIUM; SOFTWARE; THERMODYNAMICS;

EID: 33847031375     PISSN: 0039128X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.steroids.2006.11.011     Document Type: Article

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