cd8ee58da1f0d8ab1fdb6abd8b7a19759878604a,regtests/sinematrix.py,SineMatrixTests,test_parallel_sparse,#SineMatrixTests#,111
Before Change
// Non-flattened output
desc = SineMatrix(n_atoms_max=5, permutation="none", flatten=False, sparse=True)
output = [x.toarray() for x in desc.create(
system=samples,
n_jobs=2,
)]
assumed = np.empty((2, 5, 5))
assumed[0] = desc.create(samples[0]).toarray()
assumed[1] = desc.create(samples[1]).toarray()
self.assertTrue(np.allclose(np.array(output), assumed))
After Change
// Non-flattened output
desc = SineMatrix(n_atoms_max=5, permutation="none", flatten=False, sparse=True)
output = desc.create(
system=samples,
n_jobs=2,
).todense()
assumed = np.empty((2, 5, 5))
assumed[0] = desc.create(samples[0]).todense()
assumed[1] = desc.create(samples[1]).todense()
self.assertTrue(np.allclose(np.array(output), assumed))
In pattern: SUPERPATTERN
Frequency: 3
Non-data size: 8
Instances
Project Name: SINGROUP/dscribe
Commit Name: cd8ee58da1f0d8ab1fdb6abd8b7a19759878604a
Time: 2021-02-05
Author: lauri.himanen@gmail.com
File Name: regtests/sinematrix.py
Class Name: SineMatrixTests
Method Name: test_parallel_sparse
Project Name: SINGROUP/dscribe
Commit Name: 24c799a9ad0f0e4ebfdaafeeee3c20c119059498
Time: 2021-02-05
Author: lauri.himanen@gmail.com
File Name: regtests/coulombmatrix.py
Class Name: CoulombMatrixTests
Method Name: test_parallel_sparse
Project Name: SINGROUP/dscribe
Commit Name: 7f67c4ba6e955bef7d5645b8317a493281881b3d
Time: 2021-02-05
Author: lauri.himanen@gmail.com
File Name: regtests/ewaldsummatrix.py
Class Name: EwaldSumMatrixTests
Method Name: test_parallel_sparse