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remove forgotten debug
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OMalenfantThuot committed Apr 13, 2021
1 parent f58b994 commit f47f07b
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1 change: 0 additions & 1 deletion mlcalcdriver/calculators/schnetpack.py
Expand Up @@ -106,7 +106,6 @@ def run(
collect_triples=self.model_type == "wacsf",
)
data_loader = AtomsLoader(data, batch_size=batch_size)
print(data_loader)

pred = []
if derivative == 0:
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