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5a0e691 feb3584 f0992bc 5a0e691 fb8c550 5a0e691 99fb209 3fba508 8e3419e 0c3a0da 4939f56 2572d7f 5370232 | 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 | fastapi uvicorn slowapi redis httpx aiohttp biopython>=1.80 # PairwiseAligner + substitution_matrices (Bio.Align) litellm sentry-sdk python-dotenv supabase reportlab pydantic[email] rdkit numpy openmm>=8.0 # OpenMM is on PyPI since 8.0 (pip-installable in Dockerfile and Render) openbabel-wheel # obabel CLI — PDBQT prep for docking (SMILES→PDBQT, PDB→PDBQT receptor) pymol-open-source-whl>=3.2 # unofficial wheel of open-source PyMOL; provides the `pymol2` module (headless cleanup + .pse export); 3.2 line supports numpy>=2 # primer3-py>=2.0.3 (optional — requires C compiler; installed separately in Dockerfile) # dev / testing pytest>=7.0 httpx>=0.24 |