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requirements.txt
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altair==5.4.1
asttokens==2.4.1
attrs==24.2.0
backcall==0.2.0
beautifulsoup4==4.12.3
biopython==1.84
bleach==6.2.0
blinker==1.8.2
cachetools==5.5.0
certifi==2024.8.30
charset-normalizer==3.4.0
click==8.1.7
comm==0.2.2
debugpy==1.8.7
decorator==5.1.1
defusedxml==0.7.1
docopt==0.6.2
exceptiongroup==1.2.2
executing==2.1.0
fastjsonschema==2.20.0
filelock==3.16.1
fsspec==2024.10.0
gitdb==4.0.11
GitPython==3.1.43
idna==3.10
ipykernel==6.29.5
ipython==8.12.3
jedi==0.19.1
Jinja2==3.1.4
jsonschema==4.23.0
jsonschema-specifications==2024.10.1
jupyter_client==8.6.3
jupyter_core==5.7.2
jupyterlab_pygments==0.3.0
markdown-it-py==3.0.0
MarkupSafe==3.0.2
matplotlib-inline==0.1.7
mdurl==0.1.2
mistune==3.0.2
mpmath==1.3.0
narwhals==1.12.1
nbclient==0.10.0
nbconvert==7.16.4
nbformat==5.10.4
nest-asyncio==1.6.0
networkx==3.4.2
numpy==2.1.2
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-nccl-cu12==2.21.5
nvidia-nvjitlink-cu12==12.4.127
nvidia-nvtx-cu12==12.4.127
packaging==24.1
pandas==2.2.3
pandocfilters==1.5.1
parso==0.8.4
pexpect==4.9.0
pickleshare==0.7.5
pillow==10.4.0
pipreqs==0.5.0
platformdirs==4.3.6
plotly==5.24.1
prompt_toolkit==3.0.48
protobuf==5.28.3
psutil==6.1.0
ptyprocess==0.7.0
pure_eval==0.2.3
pyarrow==18.0.0
pydeck==0.9.1
Pygments==2.18.0
python-dateutil==2.9.0.post0
pytz==2024.2
pyzmq==26.2.0
referencing==0.35.1
requests==2.32.3
rich==13.9.4
rpds-py==0.20.1
six==1.16.0
smmap==5.0.1
soupsieve==2.6
stack-data==0.6.3
streamlit==1.39.0
sympy==1.13.1
tenacity==9.0.0
tinycss2==1.4.0
toml==0.10.2
torch==2.5.1
torchaudio==2.5.1
torchvision==0.20.1
tornado==6.4.1
traitlets==5.14.3
triton==3.1.0
typing_extensions==4.12.2
tzdata==2024.2
urllib3==2.2.3
watchdog==5.0.3
wcwidth==0.2.13
webencodings==0.5.1
yarg==0.1.9
chembl_webresource_client==0.10.9