Commit | Date | |
---|---|---|
[r17149]
by
bugman
Better backwards compatibility of old relax results and state XML files for the interatomic design. The MoleculeContainer._back_compat_hook() method has been shifted into the |
2012-07-03 08:18:17 | Tree |
2012-07-03 07:33:47 | Tree | |
[r17147]
by
bugman
Converted the Angles.test_angles() system test and associated script to the interatomic data design. |
2012-07-03 07:29:26 | Tree |
2012-07-03 07:28:28 | Tree | |
[r17145]
by
bugman
Merged revisions 17142 via svnmerge from ........ |
2012-07-02 20:10:23 | Tree |
[r17144]
by
bugman
Converted generic_fns.structure.geometric.create_vector_dist() to the interatomic data design. |
2012-07-02 20:09:16 | Tree |
2012-07-02 20:08:15 | Tree | |
[r17142]
by
bugman
Improvement for the RelaxNoVectorsError class - the data pipe name is now optional. The print outs have been improved as well. |
2012-07-02 20:07:41 | Tree |
[r17141]
by
bugman
Fix for the model-free duplicate_data() method, again for the interatomic data design. |
2012-07-02 19:42:29 | Tree |
[r17140]
by
bugman
Merged revisions 17139 via svnmerge from ........ |
2012-07-02 19:41:21 | Tree |