diff --git a/modules/mol/alg/tests/test_ligand_scoring.py b/modules/mol/alg/tests/test_ligand_scoring.py index 7965281e9b9411eb66bedfee05cdfc0b60ea97c2..df2cd5287185328197d240fa5755818af91d69dc 100644 --- a/modules/mol/alg/tests/test_ligand_scoring.py +++ b/modules/mol/alg/tests/test_ligand_scoring.py @@ -331,7 +331,7 @@ class TestLigandScoring(unittest.TestCase): ed.UpdateXCS() with self.assertRaises(RuntimeError): - sc = LigandScorer(mdl, trg, [mdl.FindResidue("I", 1)], [trg.FindResidue("I", 1)], check_resnames=False) + sc = LigandScorer(mdl, trg, [mdl.FindResidue("I", 1)], [trg.FindResidue("I", 1)], check_resnames=True) sc._compute_scores() sc = LigandScorer(mdl, trg, [mdl.FindResidue("I", 1)], [trg.FindResidue("I", 1)], check_resnames=False)