Update test_entropy.py

jimboid · web-flow · commit 3240a92a3aae · 2025-08-13T20:35:19.000+01:00
diff --git a/tests/test_CodeEntropy/test_entropy.py b/tests/test_CodeEntropy/test_entropy.py
@@ -989,6 +989,7 @@ def test_calculate_water_entropy(self, mock_get_entropy):
             None,
             mock_vibrations,
             None,
+            None,
         )
 
         mock_universe = MagicMock()
@@ -1018,6 +1019,7 @@ def test_calculate_water_entropy_minimal(self, mock_get_entropy):
                 rotational_S={("ACE_1", "WAT"): 2.0},
             ),
             None,
+            None,
         )
 
         # Simulate residue-level results already collected

Original file line number	Diff line number	Diff line change
`@@ -989,6 +989,7 @@ def test_calculate_water_entropy(self, mock_get_entropy):`
`989`	`989`	`None,`
`990`	`990`	`mock_vibrations,`
`991`	`991`	`None,`
	`992`	`+ None,`
`992`	`993`	`)`
`993`	`994`
`994`	`995`	`mock_universe = MagicMock()`
`@@ -1018,6 +1019,7 @@ def test_calculate_water_entropy_minimal(self, mock_get_entropy):`
`1018`	`1019`	`rotational_S={("ACE_1", "WAT"): 2.0},`
`1019`	`1020`	`),`
`1020`	`1021`	`None,`
	`1022`	`+ None,`
`1021`	`1023`	`)`
`1022`	`1024`
`1023`	`1025`	`# Simulate residue-level results already collected`