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Achievement: QuickdrawAchievement: YOLOAchievement: Pull Shark

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  1. merzlab/QUICK merzlab/QUICK Public

    QUICK: A GPU-enabled ab intio quantum chemistry software package

    C 162 48

  2. paesanilab/MBX paesanilab/MBX Public

    MBX is an energy and force calculator for data-driven many-body simulations.

    C++ 33 31

  3. kappa-SPL2 kappa-SPL2 Public

    Forked from tjdaas/kappa-SPL2

    Continued development to kappa-SPL2 code by Vuckovic and coworkers. Dev for complex NCI systems.

    Python