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Commit Date  
[r25806] by bugman

Fix for the axis permutation protocol in the frame order auto-analysis.

If a results file was found for one of the permutations, a return from the function would occur.
The result is that the other permutations would not be loaded or optimised.

2014-09-12 15:21:08 Tree
[r25805] by bugman

Modified the pivot position checking in specific_analyses.frame_order.data.generate_pivot().

Now the pivot is shifted to be within the limits shrunk by 100 Angstrom. This allows any PDB
representation created by the frame_order.pdb_model user function to be within the PDB limits.

2014-09-12 15:13:19 Tree
[r25804] by bugman

Modified the Frame_order.test_frame_order_pdb_model_failed_pivot system test.

This is to show that the frame_order.pdb_model user function fails if the pivot is close to but
still within the PDB coordinate limits.

2014-09-12 15:10:55 Tree
[r25803] by tlinnet

Further improved the plotting of data in repeated analysis.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.

2014-09-12 14:56:15 Tree
[r25802] by tlinnet

Implemented a correlation plot for R2eff values to be plotted for different pipes. This has the R2eff/R2eff_err plotted, which is the best way to represent this data.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.

2014-09-12 14:56:13 Tree
[r25801] by tlinnet

Fix for a bug introduced in the auto analysis of relax_fit.

A variable was called, before it was set.

2014-09-12 14:56:11 Tree
[r25800] by tlinnet

Improved the plotting of correlation plot for intensity. Now the intensity to error is plotted, which is the correct measure of this data.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.

2014-09-12 14:56:02 Tree
[r25799] by bugman

Fix for the model argument for the frame_order.pdb_model user function.

The deletion of structural models for the Monte Carlo simulations in the average domain position
representation now only happen if more than one model exists.

2014-09-12 14:55:53 Tree
[r25798] by bugman

Fix for the specific_analyses.frame_order.data.pivot_fixed() function.

This was recently introduced (r25763) when the check for PCS data was removed from this function.
To fix the problem, instead of calling base_data_types() to see if PCS data is present, the
cdp.pcs_ids data structure is checked instead.

2014-09-12 14:50:28 Tree
[r25797] by bugman

Modified the frame order auto-analysis to be more fail-safe.

Almost all of the protocol is now within a try-finally block so that the execution lock will always
be released.

2014-09-12 14:06:38 Tree
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