tqdm
pyyaml
loguru
fsspec<=2023.12.2
gcsfs
typer
prettytable
pandas
numpy
datamol
rdkit
ase
gdown
h5py>=3.8.0
dscribe
zarr
python-dotenv
s3fs
httpx

[dev]
pytest>=6.0
pytest-cov
nbconvert
black>=24
jupyterlab
pre-commit
ruff
mkdocs
mkdocs-material
mkdocs-material-extensions
mkdocstrings
mkdocs-click
mkdocs-jupyter
markdown-include
mdx_truly_sane_lists
mkdocstrings-python
