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Achievements

Achievement: StarstruckAchievement: Pull SharkAchievement: Arctic Code Vault Contributor

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  1. RxnFlow RxnFlow Public

    Synthesis-oriented generative model to discover diverse drug candidates through a large action space and GFlowNet objective.

    Python 2

  2. PharmacoNet PharmacoNet Public

    Official Github for "PharmacoNet: deep learning-guided pharmacophore modeling for ultra-large-scale virtual screening" (Chemical Science)

    Python 51 4

  3. BBAR BBAR Public

    Official Github for "Molecular generative model via retrosynthetically prepared chemical building block assembly" (Advanced Science)

    Jupyter Notebook 28 5

  4. OpenPharmaco OpenPharmaco Public

    Open-source protein-based pharmacophore modeling software

    Python 15

  5. DeepDL DeepDL Public archive

    Official github for "Drug-likeness scoring based on unsupervised learning" (Chemical Science)

    Python 19 6

  6. molvoxel molvoxel Public

    Easy-to-Use Molecular Voxelization Tool

    Python 7 1