Merge branch 'main' into reaction

# Conflicts: # datamol/reactions/__init__.py # datamol/reactions/_reactions.py
datamol-io · Sep 9, 2022 · 01b3de8 · 01b3de8
2 parents 2bc9a74 + 82a4f88
commit 01b3de8
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Showing 2 changed files with 2 additions and 2 deletions.
diff --git a/datamol/reactions/__init__.py b/datamol/reactions/__init__.py
@@ -6,4 +6,4 @@
 from ._attachments import convert_attach_to_isotope
 from ._reactions import ATTACHING_RXN
 from ._attachments import num_attachment_points
-from ._reactions import from_smarts
+from ._reactions import from_smarts
diff --git a/datamol/reactions/_reactions.py b/datamol/reactions/_reactions.py
@@ -106,4 +106,4 @@ def inverse_reaction(rxn):
     for i in range(rxn.GetNumProductTemplates()):
         rxn2.AddReactantTemplate(rxn.GetProductTemplate(i))
     rxn2.Initialize()
-    return rxn2
+    return rxn2