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rdkit-pypi
mols2grid
opencv-python-headless
altair==4.1.0
argcomplete==1.12.3
argon2-cffi==21.1.0
astor==0.8.1
attrs==21.2.0
backcall==0.2.0
backports.zoneinfo==0.2.1
base58==2.1.1
bleach==4.1.0
blinker==1.4
Bottleneck==1.3.2
cachetools==4.2.4
certifi==2021.10.8
cffi==1.15.0
charset-normalizer==2.0.9
chembl-webresource-client==0.10.7
click==7.1.2
colorama==0.4.4
debugpy==1.5.1
decorator==5.1.0
defusedxml==0.7.1
easydict==1.9
entrypoints==0.3
fonttools==4.25.0
gitdb==4.0.9
GitPython==3.1.24
idna==3.3
imageio==2.13.2
importlib-metadata==4.8.2
importlib-resources==5.4.0
ipykernel==6.6.0
ipython==7.30.1
ipython-genutils==0.2.0
ipywidgets==7.6.5
itsdangerous==2.0.1
jedi==0.18.1
jsonschema==4.2.1
jupyter-client==7.1.0
jupyter-core==4.9.1
jupyterlab-pygments==0.1.2
jupyterlab-widgets==1.0.2
matplotlib-inline==0.1.3
mistune==0.8.4
mkl-fft==1.3.1
mkl-service==2.4.0
munkres==1.1.4
nbclient==0.5.9
nbconvert==6.3.0
nbformat==5.1.3
nest-asyncio==1.5.4
networkx==2.6.3
notebook==6.4.6
olefile==0.46
pandocfilters==1.5.0
parso==0.8.3
pickleshare==0.7.5
Pillow==8.4.0
prometheus-client==0.12.0
prompt-toolkit==3.0.23
protobuf==3.19.1
pyarrow==6.0.1
pycparser==2.21
pydeck==0.7.1
pydicom==2.2.2
Pygments==2.10.0
Pympler==0.9
pyparsing==3.0.6
pyrsistent==0.18.0
pytz==2021.3
pytz-deprecation-shim==0.1.0.post0
PyWavelets==1.2.0
PyYAML==6.0
pyzmq==22.3.0
requests==2.26.0
requests-cache==0.7.5
scikit-image==0.19.0
scipy==1.7.3
Send2Trash==1.8.0
smmap==5.0.0
streamlit==1.2.0
terminado==0.12.1
testpath==0.5.0
tifffile==2021.11.2
toml==0.10.2
toolz==0.11.2
torch==1.10.0
torchvision==0.11.1
torchxrayvision==0.0.32
tqdm==4.62.3
traitlets==5.1.1
typing_extensions==4.0.1
tzdata==2021.5
tzlocal==4.1
url-normalize==1.4.3
urllib3==1.26.7
validators==0.18.2
watchdog==2.1.6
wcwidth==0.2.5
webencodings==0.5.1
widgetsnbextension==3.5.2
wincertstore==0.2
zipp==3.6.0