update product template after generation

ReactionMechanismGenerator · May 9, 2023 · 756c631 · 756c631
1 parent fcd95d7
commit 756c631
Showing 1 changed file with 3 additions and 0 deletions.
diff --git a/rmgpy/data/kinetics/family.py b/rmgpy/data/kinetics/family.py
@@ -821,6 +821,9 @@ def load(self, path, local_context=None, global_context=None, depository_labels=
             self.reverse = local_context.get('reverse', None)
             self.reversible = True if local_context.get('reversible', None) is None else local_context.get('reversible', None)
             self.forward_template.products = self.generate_product_template(self.forward_template.reactants)
+            for entry in self.forward_template.products:
+                if isinstance(entry.item,Group):
+                    entry.item.update()
             if self.reversible:
                 self.reverse_template = Reaction(reactants=self.forward_template.products,
                                                  products=self.forward_template.reactants)