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  1. PSI4Helper PSI4Helper Public

    Java

  2. blog blog Public

    Shared iPython Notebooks

    Jupyter Notebook 1

  3. marpat.github.io marpat.github.io Public

    HTML 1

  4. NboScan NboScan Public

    Java GUI app to process Gaussian PES files

    Java

  5. pes_nbo pes_nbo Public

    Python script with core capabilities of the NboScan Java GUI app

    Python 1