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. Journal of Chemical Information and Computer Sciences, 62(13):3180-3190, 2022. [doi]
@article{HamzicLDSFGR22,
title = {Predicting In Vivo Compound Brain Penetration Using Multi-task Graph Neural Networks},
author = {Seid Hamzic and Richard A. Lewis and Sandrine Desrayaud and Cihan Soylu and Mike Fortunato and Grégori Gerebtzoff and Raquel Rodríguez-Pérez},
year = {2022},
doi = {10.1021/acs.jcim.2c00412},
url = {https://doi.org/10.1021/acs.jcim.2c00412},
researchr = {https://researchr.org/publication/HamzicLDSFGR22},
cites = {0},
citedby = {0},
journal = {Journal of Chemical Information and Computer Sciences},
volume = {62},
number = {13},
pages = {3180-3190},
}