Corrected error creating new structures

molssi-seamm · Nov 10, 2023 · 3a5d8e9 · 3a5d8e9
1 parent 1554482
commit 3a5d8e9
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/from_smiles_step/from_smiles.py b/from_smiles_step/from_smiles.py
@@ -102,7 +102,7 @@ def run(self):
         notation = P["notation"]
 
         # Get the system
-        system, configuration = self.get_system_configuration(P)
+        system, configuration = self.get_system_configuration(P, same_as=None)
 
         # Create the structure in the given configuration
         text = P["smiles string"]