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torchani
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Grade
Name
Complexity
Churn
Issues
A
tests\test_jit_builtin_models.py
6 4 -
A
tests\test_grad.py
6 4 -
A
tests\test_forces.py
7 5 -
A
tests\test_ensemble.py
7 4 -
A
tests\test_energies.py
13 8 -
A
tests\test_data\inputtrain.yaml
 1 -
A
tests\test_data.py
21 6 -
C
tests\test_cuaev.py
28 13 6
A
tests\test_ase.py
9 7 -
A
tests\test_al.py
7 3 -
A
tests\test_aev_tripeptide_md.py
2 3 -
A
tests\test_aev_nist.py
2 3 -
A
tests\test_aev_benzene_md.py
2 3 -
A
tests\test_aev.py
46 8 -
A
tests\common_aev_test.py
3 5 -
A
setup.py
19 16 1
A
examples\vibration_analysis.py
 3 -
A
examples\nnp_training_force.py
4 3 5
B
examples\nnp_training.py
4 5 5
A
examples\neurochem_trainer.py
1 1 -