Downloads in the 30 and 7 days to October 10, 2026. Refreshed weekly.
Package Information
No reported malware or high/critical advisories · Details
The current version has no OSV.dev malware reports and no critical or high-severity vulnerabilities.
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Dependencies
- numpy >=1.24.0
- pydantic !=2.0.1,!=2.1.0,~=2.0
- pynauty >=2.8.8.1
- qcconst >=0.2.1
- qcdata >=0.17.0
- rustworkx >=0.17.1
- sympy >=1.14.0
- typing-extensions >=4.12.2
5 optional dependencies
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numba>=0.57.0[fast]extra == "fast"
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openbabel-wheel>=3.1.1.21[openbabel]extra == "openbabel"
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openbabel-wheel>=3.1.1.21[all]extra == "all"
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rdkit>=2024.9.6[all]extra == "all"
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rdkit>=2024.9.6[rdkit]extra == "rdkit"