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Dependencies
- chemicals >=1.1
- numpy >=1.26
- pandas >=2.0
- pgradd >=2.9.13
- pydantic >=2.0
- rdkit >=2024.03
- scipy >=1.11
20 optional dependencies
- hypothesis[dev]
- hypothesis[all]
- mkdocs[docs]
- mkdocs[all]
- mkdocs-material[docs]
- mkdocs-material[all]
- mkdocstrings[all]
- mkdocstrings[docs]
- pgradd[all]
- pgradd[pgradd]
- pre-commit[all]
- pre-commit[dev]
- pymdown-extensions[all]
- pymdown-extensions[docs]
- pytest[dev]
- pytest[all]
- pytest-cov[all]
- pytest-cov[dev]
- ruff[all]
- ruff[dev]