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absl-py==0.13.0 git+https://github.com/biopython/biopython.git@biopython-180 git+https://github.com/Acellera/moleculekit.git@1.5.9 chex==0.0.7 dm-haiku==0.0.5 dm-tree==0.1.6 docker==5.0.0 immutabledict==2.0.0 https://storage.googleapis.com/jax-releases/jax/jax-0.3.7.tar.gz https://storage.googleapis.com/jax-releases/cuda11/jaxlib-0.3.7+cuda11.cudnn805-cp310-none-manylinux2014_x86_64.whl ml-collections==0.1.0 numpy==1.22 pandas==1.3.4 scipy tensorflow-gpu==2.8.4 torch plotly GPUtil ray==1.13.0 tqdm protobuf<4 mdtraj -f https://storage.googleapis.com/jax-releases/jax_releases.html |