APRILE: Exploring the Molecular Mechanisms of Drug Side Effects with Explainable Graph Neural Networks
Hao Xu, Shengqi Sang, Herbert Yao, Alexandra I. Herghelegiu, Haiping Lu, James T. Yurkovich, Laurence Yang
APRILE uses explainable graph neural networks to identify molecular mechanisms of polypharmacy side effects, generating explanations for over 900,000 side effect-drug pairs.
bioRxiv · Jul 2, 2021 · PreprintBioinformatics