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CardioTox net: a robust predictor for hERG channel blockade based on deep learning meta-feature ensembles

MOTIVATION: Ether-a-go-go-related gene (hERG) channel blockade by small molecules is a big concern during drug development in the pharmaceutical industry. Blockade of hERG channels may cause prolonged QT intervals that potentially could lead to cardiotoxicity. Various in-silico techniques including...

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Detalles Bibliográficos
Autores principales:	Karim, Abdul, Lee, Matthew, Balle, Thomas, Sattar, Abdul
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Springer International Publishing 2021
Materias:	Research Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8365955/ https://www.ncbi.nlm.nih.gov/pubmed/34399849 http://dx.doi.org/10.1186/s13321-021-00541-z

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