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
- biopython >=1.86
- freesasa >=2.2.0
- gast >=0.7.0
- ipywidgets >=8.1.0
- mdanalysis
- netcdf4 >=1.7.1
- numpy
- openmm >=8.3.0
- pandas >=2.2.2
- pennylane ==0.44.0
- pennylane-lightning ==0.44.0
- pennylane-lightning-gpu ==0.44.0
- pennylane-qiskit
- pillow
- plotly >=5.20.0
- psutil
- pymol-open-source
- pyyaml
- reportlab
- requests >=2.32.3
- rich >=13.9.2
- scipy >=1.11.4
- seaborn >=0.13.2
- zstandard >=0.25.0
21 optional dependencies
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black>=23.7.0[dev]extra == "dev"
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faker>=19.0.0[dev]extra == "dev"
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flake8>=6.1.0[dev]extra == "dev"
-
freezegun>=1.2.0[dev]extra == "dev"
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ipdb>=0.13.13[dev]extra == "dev"
-
ipython>=8.14.0[dev]extra == "dev"
-
isort>=5.12.0[dev]extra == "dev"
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line-profiler>=4.0.0[dev]extra == "dev"
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memory-profiler>=0.61.0[dev]extra == "dev"
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mypy>=1.5.0[dev]extra == "dev"
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pre-commit>=3.3.0[dev]extra == "dev"
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pylint>=2.17.0[dev]extra == "dev"
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pytest>=7.4.0[dev]extra == "dev"
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pytest-benchmark>=4.0.0[dev]extra == "dev"
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pytest-cov>=4.1.0[dev]extra == "dev"
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pytest-mock>=3.11.1[dev]extra == "dev"
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pytest-timeout>=2.1.0[dev]extra == "dev"
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pytest-xdist>=3.3.1[dev]extra == "dev"
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responses>=0.23.0[dev]extra == "dev"
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sphinx>=7.1.0[dev]extra == "dev"
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sphinx-rtd-theme>=1.3.0[dev]extra == "dev"