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Accurate Physical Property Predictions via Deep Learning

Neural networks and deep learning have been successfully applied to tackle problems in drug discovery with increasing accuracy over time. There are still many challenges and opportunities to improve molecular property predictions with satisfactory accuracy even further. Here, we proposed a deep-lear...

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Detalles Bibliográficos
Autores principales: Hou, Yuanyuan, Wang, Shiyu, Bai, Bing, Chan, H. C. Stephen, Yuan, Shuguang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8912091/
https://www.ncbi.nlm.nih.gov/pubmed/35268770
http://dx.doi.org/10.3390/molecules27051668