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  1. SSTMap SSTMap Public

    Forked from KurtzmanLab/SSTMap

    Solvation Structure and Thermodynamic Mapping

    Python

  2. sstmap_test_suite sstmap_test_suite Public

    Forked from KurtzmanLab/sstmap_test_suite

    Test systems for SSTMap

    Python

  3. pymcce pymcce Public

    A suite of tools to analyze Monte Carlo simulations generated from MCCE.

    Python 2

  4. ProtonHopping ProtonHopping Public

    Data and code for Proton Hopping project

    Smarty

  5. bbbp_ml_study bbbp_ml_study Public

    Application of machine learning methods on blood brain barrier prediction (BBBP) dataset

    Jupyter Notebook

  6. toyNN toyNN Public

    A bare-bones library for implementing basic deep learning neural networks

    Python