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    • MOSAICS

      Public
      A collection of tools for characterizing membrane structure and dynamics within simulated trajectories of molecular systems.
      C++
      Other
      4000Updated Jan 20, 2026Jan 20, 2026
    • cnt_builder

      Public archive
      Python
      0000Updated Dec 23, 2025Dec 23, 2025
    • nmp_qc

      Public
      Our own implementation of Neural Message Passing for Computer Vision paper
      Python
      MIT License
      84000Updated Sep 25, 2025Sep 25, 2025
    • mpnn

      Public
      Implementation of message-passing neural net (MPNN)
      Jupyter Notebook
      MIT License
      3000Updated Oct 13, 2022Oct 13, 2022
    • Generative Models for Graph-Based Protein Design
      Python
      MIT License
      64000Updated Dec 24, 2020Dec 24, 2020
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