Commit | Date | |
---|---|---|
[r17110]
by
bugman
Fix for the model-free _determine_model_type() method. This should skip deselected spin rather than spins without relaxation data! |
2012-06-28 17:44:16 | Tree |
2012-06-28 16:35:37 | Tree | |
2012-06-28 16:35:01 | Tree | |
[r17107]
by
bugman
Fix for the rdc.read user function - values and errors of None in the file are supported again. This was broken with the interatomic data redesign. |
2012-06-28 16:34:19 | Tree |
2012-06-28 16:23:47 | Tree | |
2012-06-28 15:40:48 | Tree | |
[r17104]
by
bugman
The Scientific Python structural object are_bonded() now uses 2.0 Angstrom as a cutoff radius. |
2012-06-28 15:40:26 | Tree |
2012-06-28 15:27:37 | Tree | |
[r17102]
by
bugman
Added the are_bonded() and get_molecule() methods for the Scientific Python PDB reader. This is now needed for defining interatomic vectors in the interatomic data design. |
2012-06-28 15:23:49 | Tree |
2012-06-28 14:46:34 | Tree |