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  1. kochgroup/intro_pharma_ai kochgroup/intro_pharma_ai Public

    A collection of Jupyter Notebooks that are designed to teach life science students about deep learning.

    Jupyter Notebook 133 24

  2. metis metis Public

    Python-based GUI to collect Feedback of Chemist in Molecules

    Python 36 10

  3. kochgroup/kinase_nnfp kochgroup/kinase_nnfp Public

    Code to generate kinase-specific fingerprints based on the ECFP4 1024bits

    Python 6 5

  4. kochgroup/neural_npfp kochgroup/neural_npfp Public

    Repository to recreate experiments and calculate the Neural Natural Product Fingerprint.

    Python 2 1