"Conformalized Graph Learning for Molecular ADMET Property Prediction and ..."

Peiyao Li et al. (2024)

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DOI: 10.1021/ACS.JCIM.4C01139

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type: Journal Article

metadata version: 2025-01-08

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Peiyao Li, Lan Hua, Zhechao Ma, Wenbo Hu, Ye Liu, Jun Zhu:
Conformalized Graph Learning for Molecular ADMET Property Prediction and Reliable Uncertainty Quantification. J. Chem. Inf. Model. 64(23): 8705-8717 (2024)

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