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streamlit>=1.36.0
plotly
numpy
scipy
ase==3.23.0
torch==2.2.0
pymatgen==2025.1.9
bokeh
bokeh_sampledata
statsmodels==0.14.2
prefect==3.1.11
# py3Dmol==2.0.0.post2
# stmol==0.0.9