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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)...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2023
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| 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 |