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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...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Springer International Publishing
2021
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Materias: | |
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 |