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  1. Gramicidin_regression Gramicidin_regression Public

    Using multiple Machine Learning algorithms (in sci-kit learn) to determine how lipid environment impacts the hydrogen bonds that form the channel of the GM1 dimer.

    Jupyter Notebook

  2. Membrane-Simulation-C Membrane-Simulation-C Public

    Numerical simulation coupling membrane fluctuations with lipid density distributions.

    Makefile

  3. Membrane-Simulation-Python Membrane-Simulation-Python Public

    Numerical simulation coupling membrane fluctuations with lipid density distributions.

    Python

  4. PCA PCA Public

    Run Principal Component Analysis on MD simulation data. This is an example of VDAC in a lipid bilayer.

    Python