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How to approach machine learning-based prediction of drug/compound–target interactions

The identification of drug/compound–target interactions (DTIs) constitutes the basis of drug discovery, for which computational predictive approaches have been developed. As a relatively new data-driven paradigm, proteochemometric (PCM) modeling utilizes both protein and compound properties as a pai...

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Detalles Bibliográficos
Autores principales: Atas Guvenilir, Heval, Doğan, Tunca
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9901167/
https://www.ncbi.nlm.nih.gov/pubmed/36747300
http://dx.doi.org/10.1186/s13321-023-00689-w