absl-py==1.1.0
alabaster==0.7.12
argon2-cffi==21.3.0
argon2-cffi-bindings==21.2.0
astunparse==1.6.3
attrdict==2.0.1
attrs==21.4.0
autopep8==1.6.0
azure-core==1.24.2
azure-identity==1.10.0
azure-storage-blob==12.13.0
Babel==2.10.3
backcall==0.2.0
beautifulsoup4==4.11.1
bleach==5.0.1
cachetools==5.2.0
certifi==2022.6.15
cffi==1.15.1
charset-normalizer==2.1.0
chex==0.1.3
click==8.1.3
colorama==0.4.5
cryptography==37.0.4
cycler==0.11.0
Cython==0.29.32
debugpy==1.6.2
decorator==5.1.1
defusedxml==0.7.1
# dgl==0.4.3.post2
dglgo==0.0.2
dill==0.3.5.1
dm-clrs==1.0.0
dm-haiku==0.0.7
dm-tree==0.1.7
docopt==0.6.2
docutils==0.19
dpu-utils==0.6.1
entrypoints==0.4
etils==0.6.0
fastjsonschema==2.16.1
flatbuffers==1.12
fonttools==4.34.4
gast==0.4.0
google-auth==2.9.1
google-auth-oauthlib==0.4.6
google-pasta==0.2.0
googleapis-common-protos==1.56.4
greenlet==1.1.2
grpcio==1.47.0
h5py==3.7.0
idna==3.3
imagesize==1.4.1
importlib-metadata==4.12.0
importlib-resources==5.8.0
ipykernel==6.15.1
ipython==7.34.0
ipython-genutils==0.2.0
isodate==0.6.1
isort==5.10.1
# jax==0.3.14
# jaxlib==0.3.14
jedi==0.18.1
Jinja2==3.1.2
jmp==0.0.2
joblib==1.1.0
jsonschema==4.7.2
jupyter-client==7.3.4
jupyter-core==4.11.1
jupyterlab-pygments==0.2.2
keras==2.9.0
Keras-Preprocessing==1.1.2
kiwisolver==1.4.4
libclang==14.0.1
littleutils==0.2.2
lmdb==1.3.0
Markdown==3.4.1
MarkupSafe==2.1.1
matplotlib==3.5.2
matplotlib-inline==0.1.3
memory-profiler==0.60.0
mendeleev==0.10.0
mistune==0.8.4
more-itertools==8.13.0
msal==1.18.0
msal-extensions==1.0.0
msrest==0.7.1
nbclient==0.6.6
nbconvert==6.5.0
nbformat==5.4.0
nest-asyncio==1.5.5
networkx==2.6.3
notebook==6.4.12
numpy==1.21.6
numpydoc==1.4.0
oauthlib==3.2.0
ogb==1.3.3
opt-einsum==3.3.0
optax==0.1.3
outdated==0.2.1
packaging==21.3
pandas==1.3.5
pandocfilters==1.5.0
parso==0.8.3
pexpect==4.8.0
pickleshare==0.7.5
Pillow==9.2.0
portalocker==2.5.1
prometheus-client==0.14.1
promise==2.3
prompt-toolkit==3.0.30
protobuf==3.19.4
psutil==5.9.1
ptyprocess==0.7.0
pyasn1==0.4.8
pyasn1-modules==0.2.8
pycodestyle==2.9.1
pycparser==2.21
pydantic==1.9.1
pyfiglet==0.8.post1
Pygments==2.12.0
PyJWT==2.4.0
pyparsing==3.0.9
pyrsistent==0.18.1
python-dateutil==2.8.2
pytz==2022.1
PyYAML==6.0
pyzmq==23.2.0
rdkit==2022.3.4
rdkit-pypi==2022.3.4
regex==2022.7.25
requests==2.28.1
requests-oauthlib==1.3.1
rsa==4.8
ruamel.yaml==0.17.21
ruamel.yaml.clib==0.2.6
scikit-learn==1.0.2
scipy==1.7.3
Send2Trash==1.8.0
sentencepiece==0.1.96
SetSimilaritySearch==0.1.7
six==1.16.0
snowballstemmer==2.2.0
soupsieve==2.3.2.post1
Sphinx==5.1.1
sphinxcontrib-applehelp==1.0.2
sphinxcontrib-devhelp==1.0.2
sphinxcontrib-htmlhelp==2.0.0
sphinxcontrib-jsmath==1.0.1
sphinxcontrib-qthelp==1.0.3
sphinxcontrib-serializinghtml==1.1.5
SQLAlchemy==1.4.39
tabulate==0.8.10
# tensorboard==2.9.1
# tensorboard-data-server==0.6.1
# tensorboard-plugin-wit==1.8.1
# tensorboardX==2.5.1
# tensorflow-estimator==2.9.0
# tensorflow-io-gcs-filesystem==0.26.0
# tensorflow-metadata==1.9.0
termcolor==1.1.0
terminado==0.15.0
tfds-nightly==4.5.2.dev202204190046
threadpoolctl==3.1.0
tinycss2==1.1.1
toml==0.10.2
toolz==0.12.0
# torch==1.12.0
# torch-cluster==1.6.0
# torch-geometric==2.0.4 -f https://data.pyg.org/whl/torch-1.12.0+cu113.html
# torch-scatter -f https://data.pyg.org/whl/torch-1.12.1+cu113.html
# torch-sparse -f https://data.pyg.org/whl/torch-1.12.1+cu113.html
# torch-spline-conv==1.2.1 -f https://data.pyg.org/whl/torch-1.12.0+cu113.html
# torchaudio==0.12.0
# torchvision==0.13.0
tornado==6.2
tqdm==4.64.0
traitlets==5.3.0
typer==0.6.1
typing_extensions==4.3.0
urllib3==1.26.10
wcwidth==0.2.5
webencodings==0.5.1
Werkzeug==2.1.2
wrapt==1.14.1
zipp==3.8.1
