"Combining Group-Contribution Concept and Graph Neural Networks Toward ..."

Adem R. N. Aouichaoui et al. (2023)

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DOI: 10.1021/ACS.JCIM.2C01091

access: closed

type: Journal Article

metadata version: 2023-03-11

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Adem R. N. Aouichaoui, Fan Fan, Seyed Soheil Mansouri, Jens Abildskov, Gürkan Sin:
Combining Group-Contribution Concept and Graph Neural Networks Toward Interpretable Molecular Property Models. J. Chem. Inf. Model. 63(3): 725-744 (2023)

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