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BeWater23/README.md
  • Hi, I’m @BeWater23 🌊
  • I’m a PhD student who is working at the interface of Organic Chemistry and Computational Chemistry
  • I’m currently figuring out how to efficiently combine traditional Quantum Chemistry with Machine Learning and experimental data to accelarate discoveries in Asymmetric Catalysis 🚀

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  1. Get_Properties Get_Properties Public

    Forked from SigmanGroup/Get_Properties

    automated collection and processing of molecular properties from Gaussian jobs

    Python

  2. LASSO-Regression LASSO-Regression Public

    Jupyter Notebook for LASSO regression and PCA

    Jupyter Notebook

  3. LOGO LOGO Public

    Leave One Group Out Analysis

    Python

  4. python-modeling python-modeling Public

    Forked from SigmanGroup/python-modeling

    Jupyter Notebook