requirements.txt

accelerate==1.1.1
aiohappyeyeballs==2.4.3
aiohttp==3.11.2
aiosignal==1.3.1
alabaster==1.0.0
anyio==4.6.2.post1
async-timeout==5.0.1
attrs==24.2.0
babel==2.16.0
biopython==1.84
certifi==2022.12.7
charset-normalizer==2.1.1
colorama==0.4.6
docutils==0.21.2
et_xmlfile==2.0.0
exceptiongroup==1.2.2
filelock==3.13.1
frozenlist==1.5.0
fsspec==2024.2.0
gradio_client==1.4.3
h11==0.14.0
httpcore==1.0.7
httpx==0.27.2
huggingface-hub==0.26.2
idna==3.4
imagesize==1.4.1
Jinja2==3.1.3
joblib==1.4.2
lightning-utilities==0.11.8
lmdb==1.5.1
MarkupSafe==2.1.5
mpmath==1.3.0
multidict==6.1.0
networkx==3.2.1
numpy==1.26.3
numpydoc==1.8.0
oddt==0.7
openpyxl==3.1.5
packaging==24.2
pandas==2.2.3
pillow==10.2.0
propcache==0.2.0
psutil==6.1.0
Pygments==2.18.0
pyparsing==3.2.0
python-dateutil==2.9.0.post0
pytz==2024.2
PyYAML==6.0.2
rdkit==2024.3.6
requests==2.32.3
safetensors==0.4.5
scikit-learn==1.5.2
scipy==1.14.1
six==1.16.0
sniffio==1.3.1
snowballstemmer==2.2.0
Sphinx==8.1.3
sphinxcontrib-applehelp==2.0.0
sphinxcontrib-devhelp==2.0.0
sphinxcontrib-htmlhelp==2.1.0
sphinxcontrib-jsmath==1.0.1
sphinxcontrib-qthelp==2.0.0
sphinxcontrib-serializinghtml==2.0.0
sympy==1.13.1
tabulate==0.9.0
threadpoolctl==3.5.0
tomli==2.1.0
torch==2.2.0+cu121
torch-geometric==2.6.1
torch_cluster==1.6.3+pt22cu121
torch_scatter==2.1.2+pt22cu121
torch_sparse==0.6.18+pt22cu121
torch_spline_conv==1.2.2+pt22cu121
torchaudio==2.2.0+cu121
torchmetrics==1.6.0
torchvision==0.17.0+cu121
tqdm==4.67.0
typing_extensions==4.9.0
tzdata==2024.2
urllib3==1.26.13
websockets==12.0
yarl==1.17.2