Author: bugman Date: Wed Nov 19 18:27:28 2014 New Revision: 26633 URL: http://svn.gna.org/viewcvs/relax?rev=26633&view=rev Log: Expanded the N_state_model.test_5_state_xz system test for more alignment tensor basis sets.
The align_tensor.matrix_angles and align_tensor.svd user functions are now being called with the additional 'irreducible 5D', and 'unitary 9D' basis sets, to make sure these work correctly. Modified: trunk/test_suite/system_tests/scripts/n_state_model/5_state_xz.py Modified: trunk/test_suite/system_tests/scripts/n_state_model/5_state_xz.py URL: http://svn.gna.org/viewcvs/relax/trunk/test_suite/system_tests/scripts/n_state_model/5_state_xz.py?rev=26633&r1=26632&r2=26633&view=diff ============================================================================== --- trunk/test_suite/system_tests/scripts/n_state_model/5_state_xz.py (original) +++ trunk/test_suite/system_tests/scripts/n_state_model/5_state_xz.py Wed Nov 19 18:27:28 2014 @@ -28,12 +28,15 @@ self._execute_uf(uf_name='align_tensor.init', tensor='chi5 C-dom', align_id='5', domain='C', params=(-1/2., -1/2., 3/8., 0., 0.)) # Calculate the singular values. +self._execute_uf(uf_name='align_tensor.svd', basis_set='irreducible 5D', tensors=['chi1 C-dom', 'chi2 C-dom', 'chi3 C-dom', 'chi4 C-dom', 'chi5 C-dom']) self._execute_uf(uf_name='align_tensor.svd', basis_set='unitary 9D', tensors=['chi1 C-dom', 'chi2 C-dom', 'chi3 C-dom', 'chi4 C-dom', 'chi5 C-dom']) self._execute_uf(uf_name='align_tensor.svd', basis_set='unitary 5D', tensors=['chi1 C-dom', 'chi2 C-dom', 'chi3 C-dom', 'chi4 C-dom', 'chi5 C-dom']) self._execute_uf(uf_name='align_tensor.svd', basis_set='geometric 5D', tensors=['chi1 C-dom', 'chi2 C-dom', 'chi3 C-dom', 'chi4 C-dom', 'chi5 C-dom']) # Calculate the angles between the matrices. self._execute_uf(uf_name='align_tensor.matrix_angles', basis_set='matrix', tensors=['chi1 C-dom', 'chi2 C-dom', 'chi3 C-dom', 'chi4 C-dom', 'chi5 C-dom']) +self._execute_uf(uf_name='align_tensor.matrix_angles', basis_set='irreducible 5D', tensors=['chi1 C-dom', 'chi2 C-dom', 'chi3 C-dom', 'chi4 C-dom', 'chi5 C-dom']) +self._execute_uf(uf_name='align_tensor.matrix_angles', basis_set='unitary 9D', tensors=['chi1 C-dom', 'chi2 C-dom', 'chi3 C-dom', 'chi4 C-dom', 'chi5 C-dom']) self._execute_uf(uf_name='align_tensor.matrix_angles', basis_set='unitary 5D', tensors=['chi1 C-dom', 'chi2 C-dom', 'chi3 C-dom', 'chi4 C-dom', 'chi5 C-dom']) self._execute_uf(uf_name='align_tensor.matrix_angles', basis_set='geometric 5D', tensors=['chi1 C-dom', 'chi2 C-dom', 'chi3 C-dom', 'chi4 C-dom', 'chi5 C-dom']) @@ -53,12 +56,15 @@ self._execute_uf(uf_name='align_tensor.reduction', full_tensor='chi5 C-dom', red_tensor='chi5 N-dom') # Calculate the singular values. +self._execute_uf(uf_name='align_tensor.svd', basis_set='irreducible 5D', tensors=['chi1 N-dom', 'chi2 N-dom', 'chi3 N-dom', 'chi4 N-dom', 'chi5 N-dom']) self._execute_uf(uf_name='align_tensor.svd', basis_set='unitary 9D', tensors=['chi1 N-dom', 'chi2 N-dom', 'chi3 N-dom', 'chi4 N-dom', 'chi5 N-dom']) self._execute_uf(uf_name='align_tensor.svd', basis_set='unitary 5D', tensors=['chi1 N-dom', 'chi2 N-dom', 'chi3 N-dom', 'chi4 N-dom', 'chi5 N-dom']) self._execute_uf(uf_name='align_tensor.svd', basis_set='geometric 5D', tensors=['chi1 N-dom', 'chi2 N-dom', 'chi3 N-dom', 'chi4 N-dom', 'chi5 N-dom']) # Calculate the angles between the matrices. self._execute_uf(uf_name='align_tensor.matrix_angles', basis_set='matrix', tensors=['chi1 N-dom', 'chi2 N-dom', 'chi3 N-dom', 'chi4 N-dom', 'chi5 N-dom']) +self._execute_uf(uf_name='align_tensor.matrix_angles', basis_set='irreducible 5D', tensors=['chi1 N-dom', 'chi2 N-dom', 'chi3 N-dom', 'chi4 N-dom', 'chi5 N-dom']) +self._execute_uf(uf_name='align_tensor.matrix_angles', basis_set='unitary 9D', tensors=['chi1 N-dom', 'chi2 N-dom', 'chi3 N-dom', 'chi4 N-dom', 'chi5 N-dom']) self._execute_uf(uf_name='align_tensor.matrix_angles', basis_set='unitary 5D', tensors=['chi1 N-dom', 'chi2 N-dom', 'chi3 N-dom', 'chi4 N-dom', 'chi5 N-dom']) self._execute_uf(uf_name='align_tensor.matrix_angles', basis_set='geometric 5D', tensors=['chi1 N-dom', 'chi2 N-dom', 'chi3 N-dom', 'chi4 N-dom', 'chi5 N-dom']) _______________________________________________ relax (http://www.nmr-relax.com) This is the relax-commits mailing list relax-commits@gna.org To unsubscribe from this list, get a password reminder, or change your subscription options, visit the list information page at https://mail.gna.org/listinfo/relax-commits