absl-py==2.1.0
aiobotocore==2.12.2
aiohttp==3.9.3
aioitertools==0.11.0
aiosignal==1.3.1
anndata==0.10.6
annotated-types==0.6.0
anyio==4.3.0
array_api_compat==1.6
asttokens==2.4.1
astunparse==1.6.3
async-timeout==4.0.3
attrs==23.2.0
autogluon.common==0.7.0
autogluon.core==0.7.0
autogluon.features==0.7.0
autogluon.tabular==0.7.0
autokeras==1.0.20
beautifulsoup4==4.12.3
biopython==1.78
biothings-client==0.3.1
blis==0.7.11
blosc2==2.5.1
boto3==1.34.68
botocore==1.34.51
cachetools==5.3.3
catalogue==2.0.10
catboost==1.1.1
cattrs==23.2.3
cellxgene-census==1.10.2
certifi==2024.2.2
charset-normalizer==3.3.2
chembl-webresource-client==0.10.9
click==8.0.4
cloudpathlib==0.16.0
cloudpickle==3.0.0
cmcrameri==1.8
coloredlogs==15.0.1
comm==0.2.2
confection==0.1.4
contourpy==1.2.0
cycler==0.12.1
cymem==2.0.8
dask==2024.3.1
dataclasses==0.6
dataclasses-json==0.6.4
decorator==5.1.1
distlib==0.3.8
docker==6.1.3
dockerfile-parse==2.0.1
easydict==1.13
emoji==2.10.1
eosce @ git+https://github.com/ersilia-os/compound-embedding-lite.git@3bef753e0f53328de858ab8dffecd6e0c4db0adf
ersilia @ git+https://github.com/ersilia-os/ersilia.git@cf1fe2c566e43dd6d1cdfe8b8477a9aedc10ff81
et-xmlfile==1.1.0
exceptiongroup==1.2.0
executing==2.0.1
exmol==3.0.3
faiss-cpu==1.8.0
fastai==2.7.14
fastcore==1.5.29
fastdownload==0.0.7
fastprogress==1.0.3
filelock==3.13.3
FLAML==1.0.2
flatbuffers==24.3.7
fonttools==4.50.0
FPSim2 @ git+https://github.com/chembl/FPSim2.git@14c4493c07302ef1d726b59150eb7b49b58d68a2
frozenlist==1.4.1
fsspec==2024.3.1
future==1.0.0
fuzzywuzzy==0.18.0
gast==0.4.0
gget==0.28.4
google-auth==2.29.0
google-auth-oauthlib==0.4.6
google-pasta==0.2.0
graphviz==0.8.4
greenlet==3.0.3
grpcio==1.43.0
h5py==3.7.0
huggingface-hub==0.20.3
humanfriendly==10.0
hyperopt==0.2.7
idna==3.6
imbalanced-learn==0.10.1
importlib_metadata==7.1.0
importlib_resources==6.4.0
inflection==0.5.1
inputimeout==1.0.4
ipython==8.22.2
ipywidgets==8.1.2
isaura @ git+https://github.com/ersilia-os/isaura.git@ce293244ad0bdd6d7d4f796d2a84b17208a87b56
jedi==0.19.1
Jinja2==3.1.3
jmespath==1.0.1
joblib==1.2.0
jsonpatch==1.33
jsonpointer==2.4
jsonschema==4.21.1
jsonschema-specifications==2023.12.1
jupyterlab_widgets==3.0.10
keras==2.10.0
Keras-Preprocessing==1.1.2
keras-tuner==1.1.3
kiwisolver==1.4.5
kt-legacy==1.0.5
langchain==0.1.13
langchain-community==0.0.29
langchain-core==0.1.33
langchain-text-splitters==0.0.1
langcodes==3.3.0
langsmith==0.1.31
lazyqsar @ git+https://github.com/ersilia-os/lazy-qsar.git@b930abc17da7b2c18be1ad48440593ca7a6edbf3
Levenshtein==0.25.0
libclang==18.1.1
lightgbm==3.3.5
llvmlite==0.42.0
locket==1.0.0
loguru==0.6.0
lolP==0.0.4
lxml==5.2.1
Markdown==3.6
MarkupSafe==2.1.5
marshmallow==3.21.1
matplotlib==3.8.3
matplotlib-inline==0.1.6
melloddy_tuner @ git+https://github.com/melloddy/MELLODDY-TUNER.git@6dacc23f2269abe3ba1b4eb73141a1a52025adb3
mordred==1.2.0
mpmath==1.3.0
msgpack==1.0.8
multidict==6.0.5
murmurhash==1.0.10
mxnet==1.9.1
mygene==3.2.2
mypy-extensions==1.0.0
mysql-connector-python==8.0.29
natsort==8.4.0
ndindex==1.8
networkx==2.8.8
numba==0.59.1
numexpr==2.9.0
numpy==1.23.5
nvidia-cublas-cu11==11.10.3.66
nvidia-cuda-nvrtc-cu11==11.7.99
nvidia-cuda-runtime-cu11==11.7.99
nvidia-cudnn-cu11==8.5.0.96
oauthlib==3.2.2
onnxruntime==1.17.1
openpyxl==3.0.10
opt-einsum==3.3.0
orjson==3.9.15
packaging==23.2
palettable==3.3.3
pandas==1.5.3
parso==0.8.3
partd==1.4.1
patsy==0.5.6
pexpect==4.9.0
pillow==10.3.0
platformdirs==4.2.0
plotly==5.20.0
preshed==3.0.9
prompt-toolkit==3.0.43
protobuf==3.19.5
psutil==5.9.8
ptyprocess==0.7.0
pure-eval==0.2.2
py-cpuinfo==9.0.0
py4j==0.10.9.7
pyairtable==2.3.3
pyarrow==15.0.2
pyarrow-hotfix==0.6
pyasn1==0.5.1
pyasn1-modules==0.3.0
pybind11==2.11.1
pydantic==2.6.3
pydantic_core==2.16.3
Pygments==2.17.2
pynndescent==0.5.11
pyparsing==3.1.2
pystow==0.5.3
PyTDC==0.4.1
python-dateutil==2.9.0.post0
python-Levenshtein==0.25.0
pytz==2024.1
PyYAML==6.0.1
rapidfuzz==3.7.0
ratelimit==2.2.1
ray==1.13.0
rdkit==2023.9.5
rdkit-pypi==2022.9.4
referencing==0.34.0
requests==2.31.0
requests-cache==1.2.0
requests-oauthlib==1.4.0
rpds-py==0.18.0
rsa==4.9
s3fs==2024.3.1
s3transfer==0.10.1
scanpy==1.9.6
scikit-learn==1.2.2
scipy==1.11.4
seaborn==0.12.2
selfies==2.1.1
session_info==1.0.0
shap==0.45.0
six==1.16.0
skunk==1.3.0
slicer==0.0.7
smart-open==6.4.0
sniffio==1.3.1
somacore==1.0.7
soupsieve==2.5
spacy==3.7.4
spacy-legacy==3.0.12
spacy-loggers==1.0.5
SQLAlchemy==2.0.29
srsly==2.4.8
stack-data==0.6.3
standardiser==0.1.9
statsmodels==0.14.1
stdlib-list==0.10.0
stylia @ git+https://github.com/ersilia-os/stylia.git@2c6409782bb398c05d066d3be408823bf2aa241b
sympy==1.12
synspace==0.3.0
tables==3.9.2
tabpfn==0.1.8
tabulate==0.9.0
tenacity==8.2.3
tensorboard==2.10.1
tensorboard-data-server==0.6.1
tensorboard-plugin-wit==1.8.1
tensorboardX==2.6.2.2
tensorflow==2.10.0
tensorflow-estimator==2.10.0
tensorflow-io-gcs-filesystem==0.36.0
termcolor==2.4.0
thinc==8.2.3
threadpoolctl==3.4.0
tiledb==0.25.1
tiledbsoma==1.7.2
tomli==2.0.1
toolz==0.12.1
torch==1.13.1
torchvision==0.14.1
tqdm==4.66.1
traitlets==5.14.2
typer==0.9.4
typing-inspect==0.9.0
typing_extensions==4.10.0
tzdata==2024.1
umap-learn==0.5.5
url-normalize==1.4.3
urllib3==2.0.7
validators==0.21.2
virtualenv==20.25.1
wasabi==1.1.2
wcwidth==0.2.13
weasel==0.3.4
websocket-client==1.7.0
Werkzeug==3.0.2
widgetsnbextension==4.0.10
wrapt==1.16.0
xgboost==1.3.3
yapf==0.40.2
yarl==1.9.4
-e git+https://github.com/HellenNamulinda/zaira-chem.git@0cfb6015d3be32b6155ea820c829cdd9398528e0#egg=zairachem
zipp==3.18.1