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.
Package Insights
((week_daily_avg - month_daily_avg) / month_daily_avg) * 100More insights and metrics
Weekly Downloads
GitHub Stars
Dependencies
- fastapi >=0.110
- httpx >=0.27
- jsonschema >=4.21
- networkx >=3.2
- numpy >=1.26
- orjson >=3.10
- pandas >=2.2
- pint >=0.23
- pydantic >=2.6
- pydantic-settings >=2.2
- python-multipart >=0.0.9
- rdflib >=7.0
- rich >=13.7
- scipy >=1.12
- structlog >=24.1
- typer >=0.12
- uvicorn >=0.29
27 optional dependencies
-
ase>=3.23[gpu]extra == "gpu"
-
ase>=3.23[materials-extras]extra == "materials-extras"
-
deepmd-kit>=3.0[gpu]python_version < "3.13" and extra == "gpu"
-
httpx>=0.27[runpod]extra == "runpod"
-
hypothesis>=6.100[dev]extra == "dev"
-
mace-torch>=0.3[gpu]extra == "gpu"
-
mypy>=1.10[dev]extra == "dev"
-
pennylane>=0.40[gpu]extra == "gpu"
-
pennylane-lightning>=0.40[gpu]extra == "gpu"
-
phonopy>=2.21[gpu]extra == "gpu"
-
phonopy>=2.21[materials-extras]extra == "materials-extras"
-
psutil>=5.9[gpu]extra == "gpu"
-
pycalphad>=0.11[gpu]extra == "gpu"
-
pycalphad>=0.11[materials-extras]extra == "materials-extras"
-
pymatgen>=2024.5[materials-extras]extra == "materials-extras"
-
pymatgen>=2024.5[gpu]extra == "gpu"
-
pyscf>=2.7[gpu]extra == "gpu"
-
pytest>=8.1[dev]extra == "dev"
-
pytest-asyncio>=0.23[dev]extra == "dev"
-
pytest-cov>=5.0[dev]extra == "dev"
-
qiskit>=1.3[gpu]extra == "gpu"
-
qiskit-nature>=0.7[gpu]extra == "gpu"
-
ruff>=0.4[dev]extra == "dev"
-
spglib>=2.4[materials-extras]extra == "materials-extras"
-
spglib>=2.4[gpu]extra == "gpu"
-
tenacity>=8.5[runpod]extra == "runpod"
-
torch>=2.4[gpu]extra == "gpu"