deep-chemistry

There are 2 repositories under deep-chemistry topic.

AstraZeneca/chemicalx
A PyTorch and TorchDrug based deep learning library for drug pair scoring. (KDD 2022)
Language:Python714 22 4388
AstraZeneca/awesome-drug-pair-scoring
Readings for "A Unified View of Relational Deep Learning for Drug Pair Scoring." (IJCAI 2022)
89 12 014