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  • University of Illinois
  • Urbana-Champaign

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@ShuklaGroup

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  1. ShuklaGroup/esmdynamic ShuklaGroup/esmdynamic Public

    ESMDynamic repo

    Python 26 1

  2. ShuklaGroup/Pi-Ensemble ShuklaGroup/Pi-Ensemble Public

    Python 3

  3. ShuklaGroup/AdaptivePy ShuklaGroup/AdaptivePy Public

    Python package for adaptive sampling of molecular dynamics trajectories

    Python 2

  4. ShuklaGroup/MaxEntVAMPNet ShuklaGroup/MaxEntVAMPNet Public

    Repository for Maximum Entropy VAMPNet Adaptive Sampling

    Python 8

  5. ShuklaGroup/MA_REAP ShuklaGroup/MA_REAP Public

    Code for multi-agent reinforcement learning-based adaptive sampling

    Python 8

  6. binder_design_loop binder_design_loop Public

    Python