pip==23.1.2
wheel==0.40.0
black==23.3.0
flake8==6.0.0
numpy==1.23.2
-f https://download.pytorch.org/whl/cu117/torch_stable.html
torch==2.0.1
twine==4.0.2
pytest==7.3.2
pytest-cov==4.1.0
pytest-sugar==0.9.7
coveralls==3.3.1
matplotlib==3.7.1
ase==3.22.1
schnetpack==1.0.1
mistune==0.8.4
sphinx<7
sphinx-rtd-theme==1.2.2
m2r2==0.3.2
