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MDIL-SNU

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  1. SevenNet SevenNet Public

    SevenNet - a graph neural network interatomic potential package supporting efficient multi-GPU parallel molecular dynamics simulations.

    Python 210 47

  2. SIMPLE-NN SIMPLE-NN Public archive

    SIMPLE-NN(SNU Interatomic Machine-learning PotentiaL packagE – version Neural Network)

    Python 48 23

  3. SIMPLE-NN_v2 SIMPLE-NN_v2 Public

    C++ 43 17

  4. AMP2 AMP2 Public

    Python 22 11

  5. SPINNER SPINNER Public

    SPINNER (Structure Prediction of Inorganic crystals using Neural Network potentials with Evolutionary and Random searches)

    C++ 15 2

  6. G-metaD G-metaD Public

    Metadynamics code on the G-space.

    C++ 15 4

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