https://github.com/Mariewelt/OpenChem

OpenChem: Deep Learning toolkit for Computational Chemistry and Drug Design Research
https://github.com/Mariewelt/OpenChem

computational-biology computational-chemistry deep-learning deep-neural-networks drug-design drug-discovery graph-convolutional-networks machine-learning predictive-modeling pytorch qsar

Last synced: 29 days ago
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OpenChem: Deep Learning toolkit for Computational Chemistry and Drug Design Research

• Host: GitHub
• URL: https://github.com/Mariewelt/OpenChem
• Owner: Mariewelt
• License: mit
• Created: 2018-07-10T01:27:33.000Z (over 6 years ago)
• Default Branch: master
• Last Pushed: 2023-11-26T05:03:36.000Z (about 1 year ago)
• Last Synced: 2024-08-02T19:01:30.265Z (4 months ago)
• Topics: computational-biology, computational-chemistry, deep-learning, deep-neural-networks, drug-design, drug-discovery, graph-convolutional-networks, machine-learning, predictive-modeling, pytorch, qsar
• Language: Python
• Homepage: https://mariewelt.github.io/OpenChem/
• Size: 162 MB
• Stars: 667
• Watchers: 36
• Forks: 112
• Open Issues: 17
• Metadata Files:
  • Readme: README.md
  • License: LICENSE

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