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SVN archive Commit Log


Commit Date  
[r9557] by bugman

A bit of a clean up of the relaxation curve fitting minimise() method.

2009-09-22 12:38:58 Tree
[r9556] by bugman

Redesigned the relaxation curve fitting grid search for the new design of the minfx grid search.

2009-09-22 12:29:24 Tree
[r9555] by bugman

Added a series of checks to the test_curve_fitting() system test.

2009-09-22 12:28:03 Tree
[r9554] by bugman

Fix for the test_opt_rigid_rand_rot() system test.

The changes to the frame order grid search broke this test.

2009-09-22 11:15:40 Tree
[r9553] by bugman

Bug fix for the reading of Xplor NOE data when a line starts with '#'.

2009-09-22 10:04:37 Tree
[r9552] by bugman

Added a false, deliberately broken Xplor line to test the parsing of Xplor NOE files.

2009-09-22 09:50:31 Tree
[r9551] by bugman

Fix for the __unpack_opt_results() for the new direct calling of the grid search.

The returned results are different.

2009-09-21 18:25:52 Tree
[r9550] by bugman

Fixed the call to the grid search.

2009-09-21 17:39:41 Tree
[r9549] by bugman

Implemented the acos grid search for angular parameters of the frame order theories.

2009-09-21 17:37:50 Tree
[r9548] by bugman

Complete redesign of the grid_search() method.

The grid ops structure is no longer created, rather the grid is directly created to be passed to the
grid search algorithm. The __grid_row() method has been added to create the row of the grid
corresponding to a certain parameter.

2009-09-21 16:44:14 Tree
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