numpy==1.26.2
apsw==3.45.1.0
lmdb==1.4.1
# torch==2.1.2+cu121
torch_ema==0.3
# torch_scatter==2.1.2+pt21cu121
# torch_geometric==2.3.0
# pytorch-lightning==1.8.5
tqdm==4.66.1
wandb==0.16.0
PyYAML==6.0.1
ase==3.22.1
e3nn==0.5.1
gdown==4.6.0
transformers==4.37.2
tensorboard==2.16.2
torchdeq==0.1.0
# pyscf==2.2.1
hydra-core