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Updated 6 months ago

https://github.com/astrazeneca/chemicalx • Rank 14.1 • Science 33%

A PyTorch and TorchDrug based deep learning library for drug pair scoring. (KDD 2022)

biology chemistry deep-chemistry deep-learning drug drug-discovery drug-interaction drug-pair geometric-deep-learning geometry graph-neural-network machine-learning pharma polypharmacy pytorch smiles smiles-strings torch torchdrug
Updated 6 months ago

https://github.com/astrazeneca/awesome-drug-pair-scoring • Science 10%

Readings for "A Unified View of Relational Deep Learning for Drug Pair Scoring." (IJCAI 2022)

chemistry ddi decagon deep-chemistry deep-learning drug drug-combination drug-design drug-drug-interaction drug-repurposing drug-synergy drug-target-interactions gcn gnn graph-neural-network knowledge-graph machine-learning polypharmacy relational-learning synergy-prediction
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