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1. ChemGAN-challenge ChemGAN-challenge Public

   Code for the paper: ChemGAN challenge for drug discovery: can AI reproduce natural chemical diversity? arXiv preprint arXiv:1708.08227.

   Python 113 56

2. deepchem deepchem Public

   Forked from deepchem/deepchem

   Deep-learning models for Drug Discovery and Quantum Chemistry

   Python 16 4

3. DiversityNet-a-collaborative-benchmark-for-generative-AI-models-in-chemistry DiversityNet-a-collaborative-benchmark-for-generative-AI-models-in-chemistry Public

   GitHub of the DiversityNet project

   HTML 4 5

4. immunotherapy-response-prediction immunotherapy-response-prediction Public

   Data for the paper 'Prediction of clinical response to checkpoint blockade immunotherapy is improved with ensembling'

   1 3