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    • databases

      Public
      Python
      MIT License
      0121Updated Oct 18, 2024Oct 18, 2024
    • Parse Computational Chemistry Logfiles, But Fast-ly
      Python
      0111Updated Oct 3, 2024Oct 3, 2024
    • AutoQM

      Public
      Python
      1003Updated Aug 13, 2024Aug 13, 2024
    • Jupyter Notebook
      MIT License
      1100Updated Nov 22, 2023Nov 22, 2023
    • dgsolvdb

      Public
      Free energy of solvation database wrapper - no dependencies.
      Python
      MIT License
      0000Updated Sep 15, 2023Sep 15, 2023
    • .github

      Public
      0000Updated Mar 10, 2023Mar 10, 2023