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cpu_requirements.txt
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aiohttp==3.9.3
aiosignal==1.3.1
appdirs==1.4.4
ase==3.22.1
attrs==23.2.0
certifi==2024.2.2
charset-normalizer==3.3.2
click==8.1.7
contourpy==1.2.0
cycler==0.12.1
docker-pycreds==0.4.0
filelock==3.13.3
fonttools==4.50.0
frozenlist==1.4.1
fsspec==2024.3.1
future==1.0.0
gitdb==4.0.11
GitPython==3.1.42
h5py==3.10.0
idna==3.6
Jinja2==3.1.3
joblib==1.3.2
kaleido==0.2.1
kiwisolver==1.4.5
latexcodec==3.0.0
lightning-utilities==0.11.2
looseversion==1.3.0
MarkupSafe==2.1.5
matplotlib==3.8.3
matscipy==1.0.0
monty==2024.3.31
mpmath==1.3.0
multidict==6.0.5
networkx==3.2.1
numpy==1.26.4
packaging==24.0
palettable==3.3.3
pandas==2.2.1
pillow==10.2.0
plotly==5.20.0
protobuf==4.25.3
psutil==5.9.8
pybtex==0.24.0
pymatgen==2024.3.1
pyparsing==3.1.2
python-dateutil==2.9.0.post0
pytorch-lightning==2.2.1
pytz==2024.1
PyYAML==6.0.1
requests==2.31.0
ruamel.yaml==0.18.6
ruamel.yaml.clib==0.2.8
scikit-learn==1.4.1.post1
scipy==1.12.0
sentry-sdk==1.44.0
setproctitle==1.3.3
six==1.16.0
smmap==5.0.1
spglib==2.3.1
sympy==1.12
tabulate==0.9.0
tenacity==8.2.3
threadpoolctl==3.4.0
torch==2.2.2
torch_cluster @ git+https://github.com/rusty1s/pytorch_cluster.git@f2d99195a0003ca2d2ba9ed50d0117e2f23360e0
torch_geometric==2.5.2
torch_scatter @ git+https://github.com/curtischong/pytorch_scatter.git@91db04d32d5e9514a3fa76fcc60251cab09bcf45
torchmetrics==1.3.2
tqdm==4.66.2
typing_extensions==4.10.0
tzdata==2024.1
uncertainties==3.1.7
urllib3==2.2.1
wandb==0.16.5
yarl==1.9.4