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Dependencies
- chemparse >=0.3.1
- cirpy >=1.0.2
- fuzzywuzzy >=0.18.0
- matplotlib >=3.9.2
- molmass >=2021.6.18
- ms-entropy >=1.3.3
- numexpr >=2.10.1
- numpy >=2.1.1
- pandas >=2.2.3
- plotly >=5.24.1
- pubchempy >=1.0.4
- python-levenshtein >=0.26.1
- rdkit ==2024.3.5
- requests >=2.32.3
- scikit-learn >=1.5.2
- scipy >=1.14.1
- seaborn >=0.13.2
- tqdm >=4.66.5