Data-driven identification of structural alerts for mitigating the risk of drug-induced human liver injuries

BACKGROUND: The use of structural alerts to de-prioritize compounds with undesirable features as drug candidates has been gaining in popularity. Hundreds of molecular structural moieties have been proposed as structural alerts. An emerging issue is that strict application of these alerts will result...

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Detalles Bibliográficos
Autores principales: Liu, Ruifeng, Yu, Xueping, Wallqvist, Anders
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2015
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4339691/
https://www.ncbi.nlm.nih.gov/pubmed/25717346
http://dx.doi.org/10.1186/s13321-015-0053-y

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4339691/
https://www.ncbi.nlm.nih.gov/pubmed/25717346
http://dx.doi.org/10.1186/s13321-015-0053-y

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