From 17861c96f848b0f6b5ddca43b680b1148b3f7aaa Mon Sep 17 00:00:00 2001 From: DomInvivo Date: Fri, 19 Jan 2024 09:39:21 -0500 Subject: [PATCH] black linting --- profiling/profile_mol_to_graph.py | 4 +++- 1 file changed, 3 insertions(+), 1 deletion(-) diff --git a/profiling/profile_mol_to_graph.py b/profiling/profile_mol_to_graph.py index 63f6ba472..423f487cf 100644 --- a/profiling/profile_mol_to_graph.py +++ b/profiling/profile_mol_to_graph.py @@ -67,7 +67,9 @@ def main(): graphs = [] for s in tqdm(smiles): - mol = dm.to_mol(s) # Doesn't need `ordered=True` because this is just to test the speed of the featurizer + mol = dm.to_mol( + s + ) # Doesn't need `ordered=True` because this is just to test the speed of the featurizer graphs.append(mol_to_graph_dict(mol, **featurizer)) print(graphs[0])