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Dependencies
- fragment-selfies >=1.0.0
- loguru >=0.7.3
- numpy >=2.4.4
- rdkit >=2025.09.6
- scipy >=1.17.1
- tokenizers >=0.22.2
- torch >=2.9.1
- transformers >=5.8.0
10 optional dependencies
- accelerate[train]
- build[dev]
- cairosvg[plot]
- cycler[plot]
- matplotlib[plot]
- pandas[data]
- pytest[test]
- seaborn[plot]
- tqdm[data]
- twine[dev]