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  1. awesome-learning-digital-chemistry awesome-learning-digital-chemistry Public

    a curated list of resources for everyone interested in learning about digital chemistry

    34 3

  2. coleygroup/ms-pred coleygroup/ms-pred Public

    Predicting tandem mass spectra from molecules

    Jupyter Notebook 123 25

  3. LeMaterial/lematerial-llm-synthesis LeMaterial/lematerial-llm-synthesis Public

    An open-source multi-modal toolbox for extracting structured synthesis procedures and performance data from materials science literature at scale.

    Python 17 2

  4. llm-hackathon-template llm-hackathon-template Public template

    a barebones template to get started with for a quick prototyping project. uses uv, banners, gradio. created for the third LLM Hackathon for Applications in Materials Science and Chemistry.

    Python 8