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@hruska-lab

Hruška Lab

Computational pharmaceutical science | High-throughput atomistic simulation and explainable machine learning

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  1. metabolism-hyperparameter-optimization metabolism-hyperparameter-optimization Public

    Jupyter Notebook

  2. hruska-lab.github.io hruska-lab.github.io Public

    Hruška Lab Website

    HTML

  3. SOC-kvantove-cytochromy SOC-kvantove-cytochromy Public

    Jupyter Notebook

  4. course-python course-python Public

    Introduction to python for pharmaceutical science

    Jupyter Notebook

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