"Improved and Interpretable Prediction of Cytochrome P450-Mediated ..."

Yi Li et al. (2024)

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DOI: 10.1021/ACS.JCIM.4C01632

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type: Journal Article

metadata version: 2025-02-14

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Yi Li, Qin-Wei Xu, Guo-Lei Jian, Xiao-Ling Zhang, Hua Wang:
Improved and Interpretable Prediction of Cytochrome P450-Mediated Metabolism by Molecule-Level Graph Modeling and Subgraph Information Bottlenecks. J. Chem. Inf. Model. 64(24): 9487-9500 (2024)

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