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Explainable drug side effect prediction via biologically informed graph neural network

Early detection of potential side effects (SE) is a critical and challenging task for drug discovery and patient care. In-vitro or in-vivo approach to detect potential SEs is not scalable for many drug candidates during the preclinical stage. Recent advances in explainable machine learning may facil...

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Detalles Bibliográficos
Autores principales: Huang, Tongtong, Lin, Ko-Hong, Machado-Vieira, Rodrigo, Soares, Jair C, Jiang, Xiaoqian, Kim, Yejin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Cold Spring Harbor Laboratory 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10275013/
https://www.ncbi.nlm.nih.gov/pubmed/37333107
http://dx.doi.org/10.1101/2023.05.26.23290615