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py formatting
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even1024 committed Sep 15, 2023
1 parent 74fba33 commit e38b5bb
Showing 1 changed file with 4 additions and 1 deletion.
5 changes: 4 additions & 1 deletion api/tests/integration/tests/formats/smiles.py
Original file line number Diff line number Diff line change
Expand Up @@ -117,7 +117,10 @@
print(indigo.loadMolecule(sm).smiles())

print("*** Atropisomers ***")
mols_smiles = ["C1C(O)=C(C2C=CC(C)=CC=2N)C(C)=CC=1 |o1:3,r,wU:3.12|","C1=CC=C(C)C(C2=C(N)C=C(C)C=C2)=C1O |wU:5.4,wD:5.5|"]
mols_smiles = [
"C1C(O)=C(C2C=CC(C)=CC=2N)C(C)=CC=1 |o1:3,r,wU:3.12|",
"C1=CC=C(C)C(C2=C(N)C=C(C)C=C2)=C1O |wU:5.4,wD:5.5|",
]
for sm in mols_smiles:
print("atropisomer:")
mol = indigo.loadMolecule(sm)
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