Commit | Date | |
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[r25769]
by
bugman
Added Monte Carlo simulations to the Frame_order.test_frame_order_pdb_model_ensemble system test. This is only setting up Monte Carlo simulation data structures via the monte_carlo.setup user |
2014-09-12 08:14:16 | Tree |
[r25768]
by
bugman
Modified the Frame_order.test_frame_order_pdb_model_ensemble system test so it is set up correctly. The pivot point and moving domain are now specified. |
2014-09-12 08:12:00 | Tree |
[r25767]
by
bugman
Added a call to check_pivot() to the frame_order.select_model user function. This is to prevent this user function from being called before the pivot has been set, as otherwise |
2014-09-12 08:08:13 | Tree |
[r25766]
by
bugman
The frame order generate_pivot() function can now handle no pivot being present. At the start of this specific_analyses.frame_order.data module function, the check_pivot() function |
2014-09-12 07:58:37 | Tree |
[r25765]
by
bugman
Missing imports in the specific_analyses.frame_order.checks module. This is from the recent pipe_name argument addition in the check_pivot() function. |
2014-09-12 07:57:12 | Tree |
[r25764]
by
bugman
Modified the frame order check_pivot() function to operate on any data pipe. The function now accepts the pipe_name argument so that checks can happen on any data pipe. |
2014-09-12 07:54:31 | Tree |
[r25763]
by
bugman
Simplified the operation of the frame_order.select_model user function. This is by removing the check of PCS data from the specific_analyses.frame_order.data.pivot_fixed() |
2014-09-12 07:49:37 | Tree |
[r25762]
by
bugman
Added printouts to the specific_analyses.frame_order.parameters.update_model() function. This is to make it easier to understand why certain things fail due to the system not being fully |
2014-09-12 07:45:00 | Tree |
[r25761]
by
bugman
Created an initial Frame_order.test_frame_order_pdb_model_ensemble system test. This is to check the operation of the frame_order.pdb_model user function when an ensemble of |
2014-09-12 07:35:32 | Tree |
[r25760]
by
bugman
Created set of files for the axis permutation of the torsionless isotopic cone frame order model. |
2014-09-11 19:56:47 | Tree |