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  1. ml-catalysis-1 ml-catalysis-1 Public

    Forked from atomisticnet/ml-catalysis

    Machine Learning for Catalysis

    Python 1

  2. word_cloud word_cloud Public

    Forked from amueller/word_cloud

    A little word cloud generator in Python

    Python

  3. catmap catmap Public

    Forked from m-deimel/catmap

    Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening

    Python

  4. ml-catalysis ml-catalysis Public

    Forked from itakigawa/ml-catalysis

    Machine Learning for Catalyst Design and Discovery

    Jupyter Notebook

  5. Aaron Aaron Public

    Forked from QChASM/Aaron

    AARON (An Automated Reaction Optimizer for New catalysts) automates DFT optimizations of TS structures for asymmetric catalytic reactions.

    Perl

  6. automated-dft-catalysis automated-dft-catalysis Public

    Forked from hongyeqin/automated-dft-catalysis

    Jupyter Notebook

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