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Attention-Based Graph Neural Network for Molecular Solubility Prediction

[Image: see text] Drug discovery (DD) research is aimed at the discovery of new medications. Solubility is an important physicochemical property in drug development. Active pharmaceutical ingredients (APIs) are essential substances for high drug efficacy. During DD research, aqueous solubility (AS)...

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Detalles Bibliográficos
Autores principales:	Ahmad, Waqar, Tayara, Hilal, Chong, Kil To
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2023
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9878542/ https://www.ncbi.nlm.nih.gov/pubmed/36713733 http://dx.doi.org/10.1021/acsomega.2c06702

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