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  • Insilico Medicine

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Achievement: StarstruckAchievement: Arctic Code Vault ContributorAchievement: Pull Sharkx2

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Pinned

  1. molecularsets/moses molecularsets/moses Public

    Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models

    Python 814 241

  2. hse-aml/bayesian-methods-for-ml hse-aml/bayesian-methods-for-ml Public

    Materials for "Bayesian Methods for Machine Learning" Coursera MOOC

    Jupyter Notebook 132 112

  3. insilicomedicine/fcd_torch insilicomedicine/fcd_torch Public

    Fréchet ChemNet Distance on PyTorch

    Python 45 14

  4. insilicomedicine/GENTRL insilicomedicine/GENTRL Public

    Generative Tensorial Reinforcement Learning (GENTRL) model

    Python 598 216

  5. bayesgroup/bayesgroup.github.io bayesgroup/bayesgroup.github.io Public

    Jupyter Notebook 80 21

  6. rdkit/rdkit rdkit/rdkit Public

    The official sources for the RDKit library

    HTML 2.6k 861