Commit | Date | |
---|---|---|
[r27083]
by
bugman
Created the internal structural object model_list() method. This is to simplify the assembly of a list of all current models in the structural object. |
2014-12-11 10:34:24 | Tree |
[r27082]
by
bugman
Converted the structure.rmsd user function to the new pipes/models/molecules/atom_id design. This allows the RMSD calculation to work on atomic coordinates from different data pipes, different The Structure.test_rmsd_molecules system test has been updated for the user function argument |
2014-12-11 10:20:03 | Tree |
[r27081]
by
bugman
Docstring spelling fixes for the steady-state NOE and relaxation curve-fitting auto-analyses. |
2014-12-11 10:03:54 | Tree |
[r27080]
by
bugman
Updated the Structure.test_displacement_molecules system test. This is for the changes to the structure.displacement user function. |
2014-12-11 09:55:53 | Tree |
[r27079]
by
bugman
Another refinement for the structure ID strings returned by the assemble_coord_array() function. |
2014-12-11 09:55:24 | Tree |
[r27078]
by
bugman
Converted the structure.displacement user function to the new pipes/models/molecules/atom_id design. This allows the displacements to be calculated between atomic coordinates from different data pipes, The Structure.test_displacement system test has been updated for the user function argument changes. |
2014-12-11 09:50:16 | Tree |
[r27077]
by
bugman
Converted the internal structural displacement object to use unique IDs rather than model numbers. This allows the object to be much more flexible in what types of structures it can handle. This is |
2014-12-11 09:48:26 | Tree |
[r27076]
by
bugman
More improvements for the structure ID strings returned by the assemble_coord_array() function. |
2014-12-11 09:43:48 | Tree |
[r27075]
by
bugman
More improvements for the structure ID strings returned by the assemble_coord_array() function. |
2014-12-11 09:38:43 | Tree |
[r27074]
by
bugman
Changed the structure ID strings returned by the assemble_coord_array() function. This is from the lib.structure.internal.coordinates module. The structural object name is only |
2014-12-11 09:33:05 | Tree |