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OpenChem

OpenChem: Deep Learning toolkit for Computational Chemistry and Drug Design Research

737 stars121 forks17 issuesMIT更新于 2026/4/23

computational-biologycomputational-chemistrydeep-learningdeep-neural-networksdrug-designdrug-discoverygraph-convolutional-networksmachine-learningpredictive-modelingpytorchqsar

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