Assessment of Prediction Confidence and Domain Extrapolation of Two Structure–Activity Relationship Models for Predicting Estrogen Receptor Binding Activity

Quantitative structure–activity relationship (QSAR) methods have been widely applied in drug discovery, lead optimization, toxicity prediction, and regulatory decisions. Despite major advances in algorithms and software, QSAR models have inherent limitations associated with a size and chemical-struc...

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Detalles Bibliográficos
Autores principales: Tong, Weida, Xie, Qian, Hong, Huixiao, Shi, Leming, Fang, Hong, Perkins, Roger
Formato: Texto
Lenguaje:English
Publicado: National Institute of Environmental Health Sciences 2004
Materias:
Toxicogenomics
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1277118/
https://www.ncbi.nlm.nih.gov/pubmed/15345371
http://dx.doi.org/10.1289/txg.7125

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1277118/
https://www.ncbi.nlm.nih.gov/pubmed/15345371
http://dx.doi.org/10.1289/txg.7125

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