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Dependencies
- beautifulsoup4 >=4.12.0
- boltz-api <0.47.0,>=0.46.0
- faiss-cpu ==1.12.0
- fastapi >=0.116.0
- fastmcp <4.0.0,>=3.4.5
- graphql-core >=3.2.0
- huggingface-hub >=0.34.0
- jsonpath-ng >=1.6.0
- jsonschema >=4.23.0
- lxml >=6.0.0
- mcp <2.0.0,>=1.29.0
- numpy >=2.2.0
- openpyxl >=3.1.0
- pandas >=2.2.3
- pdfplumber >=0.11.0
- pip >=25.3
- pydantic >=2.11.0
- python-dotenv >=1.0.0
- pyyaml >=6.0.0
- rcsb-api >=1.4.0
- requests >=2.32.0
- urllib3 >=1.26
- uvicorn >=0.36.0
- websockets >=13.0
- xmltodict >=1.0.0
79 optional dependencies
-
admet-ai>=1.2.0[ml]extra == "ml"
-
aiohttp[dev]extra == "dev"
-
biopython>=1.80[bioinformatics]extra == "bioinformatics"
-
cellxgene-census>=1.10.0[singlecell]extra == "singlecell"
-
ddgs>=9.0.0[websearch]extra == "websearch"
-
easyocr>=1.7[ocr]extra == "ocr"
-
epam-indigo>=1.34.0[chem]extra == "chem"
-
faiss-cpu==1.12.0[embedding]extra == "embedding"
-
faiss-cpu==1.12.0[ml]extra == "ml"
-
flask>=2.0.0[graph]extra == "graph"
-
freesasa>=2.2.0[bioinformatics]extra == "bioinformatics"
-
furo>=2024.8.6[docs]extra == "docs"
-
google-genai>=1.36.0[gemini]extra == "gemini"
-
gradio>=4.0.0[smolagents]extra == "smolagents"
-
huggingface-hub>=0.34.0[space]extra == "space"
-
huggingface-hub>=0.34.0[ml]extra == "ml"
-
huggingface-hub>=0.34.0[embedding]extra == "embedding"
-
jinja2>=3.0.0[graph]extra == "graph"
-
kaleido>=0.2.1[visualization]extra == "visualization"
-
linkify-it-py>=2.0.0[docs]extra == "docs"
-
markitdown>=0.1.0[documents]extra == "documents"
-
matplotlib>=3.5.0[graph]extra == "graph"
-
matplotlib>=3.5.0[visualization]extra == "visualization"
-
myst-parser>=0.18[docs]extra == "docs"
-
networkx>=3.4.0[visualization]extra == "visualization"
-
networkx>=3.4.0[dev]extra == "dev"
-
networkx>=3.4.0[stats]extra == "stats"
-
openai>=1.107.0[openai]extra == "openai"
-
playwright>=1.55.0[browser]extra == "browser"
-
plotly>=5.0.0[graph]extra == "graph"
-
plotly>=5.18.0[visualization]extra == "visualization"
-
pre-commit>=2.0[dev]extra == "dev"
-
propka<4,>=3.5[protein-pka]extra == "protein-pka"
-
psutil>=5.9.0[dev]extra == "dev"
-
py3dmol>=2.0.0[visualization]extra == "visualization"
-
pydantic>=2.11.0[client]extra == "client"
-
pydata-sphinx-theme>=0.15.0[docs]extra == "docs"
-
pydot>=1.4.0[graph]extra == "graph"
-
pygraphviz>=1.7[graph]extra == "graph"
-
pyinstaller>=6.0.0[build]extra == "build"
-
pymupdf>=1.24.3[pdf]extra == "pdf"
-
pytest>=7.0[dev]extra == "dev"
-
pytest-asyncio>=0.21.0[dev]extra == "dev"
-
pytest-cov>=4.0[dev]extra == "dev"
-
pytest-html>=3.0[dev]extra == "dev"
-
pytest-mock>=3.14.0[dev]extra == "dev"
-
pytest-timeout>=2.3.1[dev]extra == "dev"
-
pytest-xdist>=3.0[dev]extra == "dev"
-
python-docx>=1.1[ocr]extra == "ocr"
-
pyyaml>=6.0.0[space]extra == "space"
-
rdkit>=2023.9.1[visualization]extra == "visualization"
-
requests>=2.32.0[space]extra == "space"
-
requests>=2.32.0[client]extra == "client"
-
requests-mock>=1.12.1[dev]extra == "dev"
-
ruff>=0.14.5[dev]extra == "dev"
-
scipy>=1.7.0[stats]extra == "stats"
-
scipy>=1.7.0[dev]extra == "dev"
-
scipy>=1.7.0[graph]extra == "graph"
-
scipy>=1.7.0[visualization]extra == "visualization"
-
sentence-transformers>=5.1.0[embedding]extra == "embedding"
-
sentence-transformers>=5.1.0[ml]extra == "ml"
-
shibuya>=0.10.0[docs]extra == "docs"
-
smolagents>=1.22.0[smolagents]extra == "smolagents"
-
sphinx>=4.0[docs]extra == "docs"
-
sphinx-autobuild>=2021.3.14[docs]extra == "docs"
-
sphinx-autodoc-typehints>=1.12.0[docs]extra == "docs"
-
sphinx-copybutton>=0.5.0[docs]extra == "docs"
-
sphinx-design>=0.3.0[docs]extra == "docs"
-
sphinx-notfound-page>=0.8[docs]extra == "docs"
-
sphinx-reredirects>=0.1.5[docs]extra == "docs"
-
sphinx-rtd-theme>=1.0[docs]extra == "docs"
-
sphinx-tabs>=3.5.0[docs]extra == "docs"
-
sympy>=1.12.0[visualization]extra == "visualization"
-
tiledbsoma>=1.15.3[singlecell]extra == "singlecell"
-
tooluniverse[ml]extra == "ml"
-
tooluniverse[embedding]extra == "embedding"
-
tooluniverse[dev]extra == "dev"
-
tooluniverse[all]extra == "all"
-
werkzeug>=2.0.0[graph]extra == "graph"