"Predicting In Vivo Compound Brain Penetration Using Multi-task Graph ..."

Seid Hamzic et al. (2022)

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DOI: 10.1021/ACS.JCIM.2C00412

access: closed

type: Journal Article

metadata version: 2022-08-25

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  - https://dblp.org/rec/journals/jcisd/HamzicLDSFGR22
Seid Hamzic, Richard A. Lewis, Sandrine Desrayaud, Cihan Soylu, Mike Fortunato, Grégori Gerebtzoff, Raquel Rodríguez-Pérez:
Predicting In Vivo Compound Brain Penetration Using Multi-task Graph Neural Networks. J. Chem. Inf. Model. 62(13): 3180-3190 (2022)

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