diff --git a/pyproject.toml b/pyproject.toml index 1122fea..3b3bdd8 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -34,7 +34,7 @@ dependencies = [ 'pytest', 'matplotlib', 'setuptools', - 'scipy==1.12.0', + 'scipy', 'statsmodels', 'plotly', 'rdkit' diff --git a/requirements.txt b/requirements.txt index 044e8d4..7b1a717 100644 --- a/requirements.txt +++ b/requirements.txt @@ -5,7 +5,7 @@ mdanalysis>=2.7.0 pytest pathlib matplotlib -scipy==1.12.0 +scipy statsmodels plotly rdkit