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  1. spectrafit-fork spectrafit-fork Public

    Forked from Anselmoo/spectrafit

    📊📈🔬 SpectraFit is a command-line and Jupyter-notebook tool for quick data-fitting based on the regular expression of distribution functions.

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    General plotting tools for computational chemistry and data analysis

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  3. ASH-cc-submit ASH-cc-submit Public

    A SLURM script to submit ASH jobs within a python3 virtual environment on ComputeCanada clusters

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    Useful scripts for my common tasks on ComputeCanada clusters

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