sqlalchemy<1.4,>=1.3
numpy>=1.13
scipy>=1.11
pandas~=1.0
python-Levenshtein-wheels~=0.13
pint~=0.22
periodictable~=1.6
httpx~=0.24
tenacity~=6.3
tqdm~=4.0
appdirs~=1.4

[:python_version < "3.9"]
importlib_resources

[deployment]
click
click-log
openbabel
python-dateutil

[development]
black~=23.7
isort~=5.12
flake8~=6.1
safety~=2.3
tox==3.28
twine~=4.0

[test]
pytest
pytest-cov
pytest-raises
pytest-mock
hypothesis
