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    • 056402

      Public
      056402 Molecular and Chemical Kinetic Modelling
      Jupyter Notebook
      MIT License
      1301Updated Jan 27, 2025Jan 27, 2025
    • MemCo

      Public
      A project aiming at predicting the Hard-Corona formed around Nanoparticles.
      MIT License
      0000Updated Nov 17, 2024Nov 17, 2024
    • DE

      Public
      Python
      0000Updated Sep 24, 2024Sep 24, 2024
    • Jupyter Notebook
      MIT License
      1209Updated Jul 31, 2024Jul 31, 2024
    • RSQM

      Public
      Shell
      MIT License
      0001Updated Mar 21, 2024Mar 21, 2024
    • EMG

      Public
      Energetic Material Development using Genetic Algorithms
      Python
      MIT License
      0000Updated Dec 18, 2023Dec 18, 2023
    • Workshop material for ARC and T3
      Jupyter Notebook
      MIT License
      0100Updated May 15, 2023May 15, 2023
    • 1Ddb

      Public
      Python
      MIT License
      0000Updated Apr 25, 2023Apr 25, 2023
    • scripts

      Public
      Jupyter Notebook
      MIT License
      0001Updated Apr 15, 2023Apr 15, 2023
    • Jupyter Notebook
      MIT License
      0000Updated Mar 21, 2023Mar 21, 2023
    • AM3DB

      Public
      3D Atom Mapping Database
      Python
      MIT License
      1100Updated Dec 29, 2022Dec 29, 2022
    • wiki

      Public
      MIT License
      0300Updated May 12, 2022May 12, 2022
    • ATtoMols

      Public
      Generate all possible combinations of atom types and convert them to Molecule objet instances
      MIT License
      0000Updated May 2, 2022May 2, 2022