Change default Compound.remove keyword, reset_labels, to True

mosdef-hub · Mar 20, 2024 · 832c8a2 · 832c8a2
1 parent ab86033
commit 832c8a2
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Showing 2 changed files with 1 addition and 2 deletions.
diff --git a/mbuild/compound.py b/mbuild/compound.py
@@ -1015,7 +1015,7 @@ def add(
                     "outside of the defined simulation box"
                 )
 
-    def remove(self, objs_to_remove, reset_labels=False):
+    def remove(self, objs_to_remove, reset_labels=True):
         """Remove children from the Compound cleanly.
 
         Parameters

diff --git a/mbuild/tests/test_compound.py b/mbuild/tests/test_compound.py
@@ -936,7 +936,6 @@ def test_remove(self, ethane):
         hydrogens = ethane7.particles_by_name("H")
         ethane7.remove(hydrogens, reset_labels=True)
 
-        print(list(ethane7.labels.keys()))
         assert list(ethane7.labels.keys()) == [
             "C",
             "C[0]",