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Dependencies
- gemmi >=0.7.5
- im-squonk2-client <7,>=6.1.0
- ipywidgets <9,>=8.1.8
- mypytools >=0.1.15
- pandas <4,>=3.0.1
- rdkit ==2025.9.6
- xchem-molparse <2,>=1.0.0