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Dependencies
- absl-py
- bio >=1.5.9
- dm-haiku >=0.0.12
- dm-tree
- einops
- fire ==0.7.0
- huggingface-hub
- hydra-core
- jax ==0.4.35
- matplotlib >=3.10.7
- mdtraj >=1.9.9
- ml-collections
- modelcif ==0.7
- requests
- stackprinter
- tensorflow-cpu >=2.12.0
- torch >=2.6.0
- torch-geometric >=2.6.1
- tqdm
- typer
- uv
7 optional dependencies
- jax[cuda]
- nvidia-cuda-nvcc-cu12[cuda]
- openmm[md]
- openmm-cuda-12[md]
- pre-commit[dev]
- pytest[dev]
- pytest-cov[dev]