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  • Université Clermont-Auvergne - Simatlab
  • Paris

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  1. ml-gle ml-gle Public

    [NeurIPS 2023] ML-Enhanced Generalized Langevin Equation for simulating Transient Anomalous Diffusion in polymer dynamics

    Python 4

  2. denoising-backmapping denoising-backmapping Public

    [Denoising-Backmapping]: source code for training and generation of an Equivariant Conditional Graph diffusion model able to generate a realistic configuration from an input CG coordinates of the s…

    Python 2