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1. aspuru-guzik-group/stiefelFM aspuru-guzik-group/stiefelFM Public

   Code for "Stiefel Flow Matching for Moment-Constrained Structure Elucidation"

   Jupyter Notebook 1

2. aspuru-guzik-group/kreed aspuru-guzik-group/kreed Public

   Code for Reflection-Equivariant Diffusion for 3D Structure Determination from Isotopologue Rotational Spectra in Natural Abundance

   Jupyter Notebook 5

3. aspuru-guzik-group/group-selfies aspuru-guzik-group/group-selfies Public

   Jupyter Notebook 57 12

4. Binbose/SpIN-Jax Binbose/SpIN-Jax Public

   Python

5. psyduck psyduck Public

   Pinnacle hackathon

   Jupyter Notebook

6. streamlit-olympus streamlit-olympus Public

   Streamlit web app for exploring Olympus

   Python