warn wrong energy type

jamesmkrieger · Nov 21, 2024 · 375d5ff · 375d5ff
1 parent 4f3320a
commit 375d5ff
Showing 1 changed file with 3 additions and 0 deletions.
diff --git a/prody/proteins/interactions.py b/prody/proteins/interactions.py
@@ -3847,6 +3847,9 @@ def showCumulativeInteractionTypes(self, **kwargs):
                 self.buildInteractionMatrixEnergy(energy_list_type=energy_list_type)
                 matrix_en = self._interactions_matrix_en
 
+            elif self._energy_type != energy_list_type:
+                LOGGER.warn('The energy type is {0}, not {1}'.format(self._energy_type, energy_list_type))
+
             matrix_en_sum = np.sum(matrix_en, axis=0)
 
             width = 0.8