matchms<=0.13.0,>=0.11.0
numpy
spec2vec>=0.6.0
h5py<3.0.0
scikit-learn==0.24.2
ms2deepscore
gensim>=4.0.0
pandas>=1.2.5
matchmsextras>=0.3.0
pubchempy
tqdm
matplotlib

[:platform_machine != "arm64"]
tensorflow<2.9

[:platform_machine == "arm64"]
tensorflow-macos<2.9
tensorflow-metal<2.9

[:python_version < "3.8"]
pickle5

[dev]
bump2version
isort>=5.1.0
prospector[with_pyroma]
pytest
pytest-cov
sphinx!=3.2.0,<4.0.0,>=3.0.0
sphinx_rtd_theme
sphinxcontrib-apidoc
yapf
rdkit
