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Achievement: QuickdrawAchievement: Pair ExtraordinaireAchievement: Arctic Code Vault ContributorAchievement: Pull Sharkx2

Achievements

Achievement: QuickdrawAchievement: Pair ExtraordinaireAchievement: Arctic Code Vault ContributorAchievement: Pull Sharkx2

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  1. espottesmith.github.io espottesmith.github.io Public

    Github Pages template for academic personal websites, forked from mmistakes/minimal-mistakes

    HTML 1

  2. MPcat MPcat Public

    An interface between the Materials Project software suite and the Schrodinger Python API, designed to allow for high-throughput execution of Jaguar and AutoTS calculations for molecular thermodynam…

    Python 13 3

  3. hydrobench hydrobench Public

    Code and data for a benchmark study of hydrolysis energy barriers using density functional theory

    Python 2

  4. CoReACTER/GPS-TS CoReACTER/GPS-TS Public

    Geodesic path search for transition-states

    Python 6 1