Explainable Fragment‐Based Molecular Property Attribution

“AI & Drug Discovery” mode has significantly promoted drug development and achieved excellent performance, especially with the rapid development of deep learning, making remarkable contributions to protecting human physiological health. However, due to the “black‐box” characteristic of the deep lear...

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Bibliografski detalji

Glavni autori:	Lingxiang Jia, Zunlei Feng, Haotian Zhang, Jie Song, Zipeng Zhong, Shaolun Yao, Mingli Song
Format:	Artigo
Jezik:	Inglês
Izdano:	Wiley 2022-10-01
Serija:	Advanced Intelligent Systems
Teme:	drug discovery explainable machine learning molecular properties
Online pristup:	https://doi.org/10.1002/aisy.202200104
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