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  1. MolOP MolOP Public

    Molecule OPerator, a molecule information extraction and operation unit

    Jupyter Notebook 3

  2. spectrum_descriptor spectrum_descriptor Public

    spectrum descriptor is a tool to extract and re-encode information from spectral image or spectral curves.

    Jupyter Notebook 1

  3. qm9star_query qm9star_query Public

    A SQLModel-based repository dedicated to helping users access the PostgreSQL-based qm9star database more easily in a Python environment.

    Jupyter Notebook 8 1

  4. ZJU-structure-and-spectroscopy ZJU-structure-and-spectroscopy Public

    一个基于Streamlit的交互式笔记网站

    Python