torch
numpy
tqdm
scipy
omegaconf
huggingface-hub>=1.31.0
rdkit
einops
gemmi
pyyaml
numba
atlasfold>=1.0.4

[cuequiv]
cuequivariance==0.10.0
cuequivariance_torch==0.10.0
cuequivariance_ops_cu12==0.10.0
cuequivariance_ops_torch_cu12==0.10.0
