Structure-Based Drug-Drug Interaction Detection via Expressive Graph Convolutional Networks and Deep Sets (Student Abstract)
Mengying Sun, Fei Wang, Olivier Elemento, Jiayu Zhou · Proceedings of the AAAI Conference on Artificial Intelligence · 2020
In this work, we proposed a DDI detection method based on molecular structures using graph convolutional networks and deep sets. We proposed a more discriminative convolutional layer compared to conventional GCN and achieved permutation invariant prediction without losing the capability of capturing complicated interactions.