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Evaluation of deep and shallow learning methods in chemogenomics for the prediction of drugs specificity

Chemogenomics, also called proteochemometrics, covers a range of computational methods that can be used to predict protein–ligand interactions at large scales in the protein and chemical spaces. They differ from more classical ligand-based methods (also called QSAR) that predict ligands for a given...

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Detalles Bibliográficos
Autores principales: Playe, Benoit, Stoven, Veronique
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7011501/
https://www.ncbi.nlm.nih.gov/pubmed/33431042
http://dx.doi.org/10.1186/s13321-020-0413-0