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120 lines (120 loc) · 2.29 KB
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aiohappyeyeballs==2.7.1
aiohttp==3.14.1
aiosignal==1.4.0
annotated-doc==0.0.4
annotated-types==0.7.0
antlr4-python3-runtime==4.9.3
anyio==4.14.2
async-timeout==5.0.1
attrs==26.1.0
cachetools==7.1.4
certifi==2026.6.17
cfgv==3.5.0
chardet==7.4.3
charset-normalizer==3.4.9
chebai==1.3.0
chebi-utils==0.2.1
chembl-structure-pipeline==1.2.4
click==8.4.2
colorama==0.4.6
descriptastorus==2.8.0
distlib==0.4.3
docstring-parser==0.18.0
exceptiongroup==1.3.1
fastobo==0.14.1
filelock==3.30.2
frozenlist==1.8.0
fsspec==2025.12.0
h11==0.16.0
hf-xet==1.5.2
httpcore==1.0.9
httpx==0.28.1
huggingface-hub==1.23.0
identify==2.6.19
idna==3.18
importlib-resources==7.1.0
iterative-stratification==0.1.9
jinja2==3.1.6
joblib==1.5.3
jsonargparse==4.49.0
lightning==2.5.1
lightning-utilities==0.15.3
markdown-it-py==4.2.0
markupsafe==3.0.3
mdurl==0.1.2
mpmath==1.3.0
multidict==6.7.1
networkx==3.4.2
nodeenv==1.10.0
numpy==2.2.6
nvidia-cublas-cu12==12.4.5.8
nvidia-cuda-cupti-cu12==12.4.127
nvidia-cuda-nvrtc-cu12==12.4.127
nvidia-cuda-runtime-cu12==12.4.127
nvidia-cudnn-cu12==9.1.0.70
nvidia-cufft-cu12==11.2.1.3
nvidia-curand-cu12==10.3.5.147
nvidia-cusolver-cu12==11.6.1.9
nvidia-cusparse-cu12==12.3.1.170
nvidia-cusparselt-cu12==0.6.2
nvidia-nccl-cu12==2.21.5
nvidia-nvjitlink-cu12==12.4.127
nvidia-nvtx-cu12==12.4.127
omegaconf==2.3.1
packaging==24.2
pandas==2.3.3
pandas-flavor==0.8.1
pbr==7.0.3
pillow==12.3.0
platformdirs==4.10.0
pluggy==1.6.0
pre-commit==4.6.0
propcache==0.5.2
protobuf==7.35.1
psutil==7.2.2
pydantic==2.13.4
pydantic-core==2.46.4
pygments==2.20.0
pyparsing==3.3.2
pyproject-api==1.9.0
pysmiles==1.1.2
python-dateutil==2.9.0.post0
python-discovery==1.4.4
pytorch-lightning==2.6.5
pytz==2026.2
pyyaml==6.0.3
rdkit==2024.3.6
regex==2026.7.10
requests==2.34.2
rich==15.0.0
safetensors==0.8.0
scikit-learn==1.7.2
scipy==1.15.3
sentry-sdk==2.66.0
setuptools==83.0.0
shellingham==1.5.4
six==1.17.0
sympy==1.13.1
threadpoolctl==3.6.0
tokenizers==0.22.2
tomli==2.4.1
torch==2.6.0
torch-geometric==2.8.0
torch-scatter==2.1.2+pt26cu124
torch-sparse==0.6.18+pt26cu124
torchmetrics==1.9.0
tox==4.27.0
tqdm==4.68.4
transformers==5.14.1
triton==3.2.0
typer==0.27.0
typeshed-client==2.12.0
typing-extensions==4.16.0
typing-inspection==0.4.2
tzdata==2026.3
urllib3==2.7.0
virtualenv==21.6.1
wandb==0.28.1
xarray==2025.6.1
xxhash==3.8.1
yarl==1.24.2