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    • Collection of evals for Inspect AI
      Python
      MIT License
      3940018Updated Jul 30, 2026Jul 30, 2026
    • Python
      MIT License
      568121Updated Jul 30, 2026Jul 30, 2026
    • Python
      MIT License
      1461Updated Jul 28, 2026Jul 28, 2026
    • Jupyter Notebook
      MIT License
      1902Updated Jul 28, 2026Jul 28, 2026
    • e3nn_mlx

      Public
      Jupyter Notebook
      Other
      0101Updated Jul 28, 2026Jul 28, 2026
    • Python
      MIT License
      0500Updated Jul 28, 2026Jul 28, 2026
    • corral

      Public
      Python
      BSD 3-Clause "New" or "Revised" License
      0143912Updated Jul 24, 2026Jul 24, 2026
    • Python
      Apache License 2.0
      1001Updated Jul 23, 2026Jul 23, 2026
    • .github

      Public
      0000Updated Jul 20, 2026Jul 20, 2026
    • secs-app

      Public
      The app to run SECS.
      Python
      GNU Affero General Public License v3.0
      1620Updated Jul 20, 2026Jul 20, 2026
    • Python
      0051Updated Jul 17, 2026Jul 17, 2026
    • PolyMetriX is a comprehensive Python library that powers the entire machine learning workflow for polymer informatics.
      Python
      MIT License
      74701Updated Jul 15, 2026Jul 15, 2026
    • Basic sanity checks for MOFs.
      Python
      MIT License
      535341Updated Jul 6, 2026Jul 6, 2026
    • secs

      Public
      SECS is a machine learning framework designed for structure elucidation from spectra such as NMR and IR.
      Jupyter Notebook
      Other
      63210Updated Jul 5, 2026Jul 5, 2026
    • Jupyter Notebook
      MIT License
      554146Updated Jul 1, 2026Jul 1, 2026
    • A place to submit conda recipes before they become fully fledged conda-forge feedstocks
      Python
      BSD 3-Clause "New" or "Revised" License
      6.2k000Updated Jul 1, 2026Jul 1, 2026
    • Kim Review Comment about LLMs for Materials
      TeX
      0000Updated Jun 27, 2026Jun 27, 2026
    • HTML
      2360Updated Jun 13, 2026Jun 13, 2026
    • chem-env

      Public
      Python
      Apache License 2.0
      2100Updated Jun 2, 2026Jun 2, 2026
    • Python
      MIT License
      1100Updated Jun 1, 2026Jun 1, 2026
    • Python
      0100Updated May 14, 2026May 14, 2026
    • JavaScript
      0000Updated Apr 26, 2026Apr 26, 2026
    • Python
      MIT License
      0000Updated Apr 12, 2026Apr 12, 2026
    • Plotting styles and helpers by LamaLab
      Python
      MIT License
      0520Updated Mar 17, 2026Mar 17, 2026
    • MatText

      Public
      Text-based modeling of materials.
      Jupyter Notebook
      MIT License
      236120Updated Mar 12, 2026Mar 12, 2026
    • GPMs-book

      Public
      TeX
      MIT License
      01131Updated Mar 12, 2026Mar 12, 2026
    • xtal2txt

      Public
      Python
      MIT License
      05100Updated Mar 4, 2026Mar 4, 2026
    • ACE-Mol

      Public
      Adaptive Chemical Embedding Model (ACE-Mol) i
      Python
      MIT License
      0200Updated Feb 10, 2026Feb 10, 2026
    • Jupyter Notebook
      MIT License
      0100Updated Feb 10, 2026Feb 10, 2026
    • macbench

      Public
      Probing the limitations of multimodal language models for chemistry and materials research
      Python
      MIT License
      12485Updated Feb 1, 2026Feb 1, 2026
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