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DEEPScreen: high performance drug–target interaction prediction with convolutional neural networks using 2-D structural compound representations

The identification of physical interactions between drug candidate compounds and target biomolecules is an important process in drug discovery. Since conventional screening procedures are expensive and time consuming, computational approaches are employed to provide aid by automatically predicting n...

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Detalhes bibliográficos
Publicado no:Chem Sci
Main Authors: Rifaioglu, Ahmet Sureyya, Nalbat, Esra, Atalay, Volkan, Martin, Maria Jesus, Cetin-Atalay, Rengul, Doğan, Tunca
Formato: Artigo
Idioma:Inglês
Publicado em: Royal Society of Chemistry 2020
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC7643205/
https://ncbi.nlm.nih.gov/pubmed/33209251
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c9sc03414e
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