"Explainable AI in drug discovery: self-interpretable graph neural network ..."

Michela Proietti et al. (2024)

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DOI: 10.1007/S10994-023-06369-Y

access: open

type: Journal Article

metadata version: 2025-03-03

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Michela Proietti, Alessio Ragno, Biagio La Rosa, Rino Ragno, Roberto Capobianco:
Explainable AI in drug discovery: self-interpretable graph neural network for molecular property prediction using concept whitening. Mach. Learn. 113(4): 2013-2044 (2024)

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