--- xtp/src/pyxtp/pyproject.toml.orig 2026-04-20 19:20:56 UTC +++ xtp/src/pyxtp/pyproject.toml @@ -9,7 +9,7 @@ authors = [ { name="Bjoern Baumeier", email="bjoernbaumeier@gmail.com" }, ] -dependencies = ["ase", "xmltodict", "h5py", "lxml", "rdkit"] +dependencies = ["ase", "xmltodict", "h5py", "lxml"] [tool.pytest.ini_options] addopts = [