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Popular repositories

  1. trioxane.github.io trioxane.github.io Public

    Interactive plots for https://doi.org/10.1021/acs.cgd.0c00753

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  2. iCPs_MLs iCPs_MLs Public

    Supporting Data for the article

    Jupyter Notebook

  3. MDTopAnal MDTopAnal Public

    Topological analysis of MD trajectories

    Jupyter Notebook

  4. StructureAnalyzer StructureAnalyzer Public

    Library for identification of low-dimensional fragments in crystal structures

    Jupyter Notebook

  5. consensus_clustering consensus_clustering Public

    Parallelised consensus clustering algorithm implementation

    Jupyter Notebook