diff --git a/src/sire/mol/__init__.py b/src/sire/mol/__init__.py index b6adf10d8..ad8004fa9 100644 --- a/src/sire/mol/__init__.py +++ b/src/sire/mol/__init__.py @@ -2156,6 +2156,9 @@ def _minimisation( if platform is not None: map.set("platform", str(platform)) + if include_constrained_energies is not None: + map.set("include_constrained_energies", include_constrained_energies) + return Minimisation( view, cutoff=cutoff,