tests/test_structure_optim.py · ec35c7dab5db1785ada6c2b047e51e6f13e120e1 · OpenDAS / torchani

Use PyTorch's TestCase to compare tensor (#533) · ec35c7da

Gao, Xiang authored Nov 13, 2020

* Use PyTorch's TestCase to compare tensor

* save

* save

* save

* save

* save

* save

* save

* save

* save

* Update test_energies.py

* Update test_ase.py

* save

* flake8

ec35c7da

test_structure_optim.py 1.19 KB

Replace test_structure_optim.py