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Merged revisions 25846-25861,25897-25898 via svnmerge from

svn+ssh://bugman@.../svn/relax/trunk

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r25846 | bugman | 2014-09-15 16:27:17 +0200 (Mon, 15 Sep 2014) | 5 lines

Added the Relax_disp.test_show_apod_rmsd_dir_to_files system test to the blacklist.

This is if the showApod program is not installed on the machine and allows the test suite to pass.
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r25847 | bugman | 2014-09-15 16:49:17 +0200 (Mon, 15 Sep 2014) | 6 lines

Extended the printout for the skipped tests in the test suite.

As tests using the NMRPipe showApod software are skipped and listed in this table, the text now
includes 'software' in the list.
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r25848 | bugman | 2014-09-15 17:00:53 +0200 (Mon, 15 Sep 2014) | 7 lines

Shifted the checks for the Dasha and Modelfree4 software into the system test __init__() method.

This is to bring this into the same design as the relaxation dispersion tests which require the
NMRPipe showApod software. Now the test suite will list either Dasha or Modelfree4 in the skipped
test table if they are not installed.
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r25849 | tlinnet | 2014-09-15 23:04:25 +0200 (Mon, 15 Sep 2014) | 3 lines

Adding another statistic method to plot for multi-data sets.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25850 | tlinnet | 2014-09-16 01:20:45 +0200 (Tue, 16 Sep 2014) | 3 lines

More adding of matplotlib snippets for plotting intermediate data.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25851 | tlinnet | 2014-09-16 01:48:57 +0200 (Tue, 16 Sep 2014) | 3 lines

Changing the range of plotting for statistics.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25852 | tlinnet | 2014-09-16 02:03:38 +0200 (Tue, 16 Sep 2014) | 3 lines

More changes to plotting for statistics.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25853 | tlinnet | 2014-09-16 02:25:02 +0200 (Tue, 16 Sep 2014) | 3 lines

Fix for axis limits when plotting stats.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25854 | tlinnet | 2014-09-16 02:44:55 +0200 (Tue, 16 Sep 2014) | 3 lines

Fix for globbing, to prevent incidentally taking wrong intensity file.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25855 | tlinnet | 2014-09-16 07:15:04 +0200 (Tue, 16 Sep 2014) | 3 lines

Correction to figure limits.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25856 | tlinnet | 2014-09-16 13:19:38 +0200 (Tue, 16 Sep 2014) | 3 lines

Implemented writing out of statistics to file.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25857 | tlinnet | 2014-09-16 13:42:13 +0200 (Tue, 16 Sep 2014) | 3 lines

Adding writing out of png files from matplotlib, when looking at statistics.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25858 | tlinnet | 2014-09-16 19:45:57 +0200 (Tue, 16 Sep 2014) | 5 lines

Another math domain checking, if ref intensity is set to 0.0, then points are skipped, rather than raising an Error.

This can happen for extremely bad dispersion data.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25859 | tlinnet | 2014-09-16 19:45:59 +0200 (Tue, 16 Sep 2014) | 5 lines

Trying implementing flexibility, when data expected data is missing.

This can be due failing of processing data, where a whole run of data is randomly skipped.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25860 | tlinnet | 2014-09-16 19:52:12 +0200 (Tue, 16 Sep 2014) | 3 lines

Better check for math domain error in intensity propertionality.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25861 | tlinnet | 2014-09-16 19:52:13 +0200 (Tue, 16 Sep 2014) | 3 lines

Removeal of initialised of dictionary, before data existence have been checked.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25897 | tlinnet | 2014-09-18 11:13:40 +0200 (Thu, 18 Sep 2014) | 3 lines

Small fix for correct check of missing of data.

Task #7826 (https://gna.org/task/index.php?7826): Write an python class for the repeated analysis of dispersion data.
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r25898 | bugman | 2014-09-18 11:47:22 +0200 (Thu, 18 Sep 2014) | 17 lines

Imported the Numdifftools 0.6.0 package into the relax source tree.

This package is extremely useful for testing the implementation of gradients, Hessians, and
Jacobians for all relax target functions. The numerical values from numdifftools can be compared to
the directly calculated values. And for analysis types where the partial derivatives with respect
to each model parameter are too complicated to calculated, or the derivatives are very complicated
and hence slow, numdifftools can be used to provide a numerical estimate for direct use in the
optimisation.

The Numdifftools package is from https://pypi.python.org/pypi/Numdifftools and
https://code.google.com/p/numdifftools/. The current version 0.6.0 has been placed into
extern/numdifftools. This is only the numdifftools package within the official distribution files
and the Python package setup.py file and associated files and directories have not been included.
The package uses the New BSD licence (the revised licence with no advertising clause) which is
compatible with the GPL v3 licence.
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bugman 2014-09-18

changed /branches/frame_order_cleanup
changed /branches/frame_order_cleanup/auto_analyses/relax_disp_repeat_cpmg.py
changed /branches/frame_order_cleanup/specific_analyses/relax_disp/optimisation.py
changed /branches/frame_order_cleanup/test_suite/system_tests/dasha.py
changed /branches/frame_order_cleanup/test_suite/system_tests/palmer.py
changed /branches/frame_order_cleanup/test_suite/system_tests/relax_disp.py
changed /branches/frame_order_cleanup/test_suite/test_suite_runner.py
copied /trunk/extern/numdifftools -> /branches/frame_order_cleanup/extern/numdifftools
/branches/frame_order_cleanup/auto_analyses/relax_disp_repeat_cpmg.py Diff Switch to side-by-side view
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/branches/frame_order_cleanup/specific_analyses/relax_disp/optimisation.py Diff Switch to side-by-side view
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/branches/frame_order_cleanup/test_suite/system_tests/dasha.py Diff Switch to side-by-side view
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/branches/frame_order_cleanup/test_suite/system_tests/palmer.py Diff Switch to side-by-side view
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/branches/frame_order_cleanup/test_suite/system_tests/relax_disp.py Diff Switch to side-by-side view
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/branches/frame_order_cleanup/test_suite/test_suite_runner.py Diff Switch to side-by-side view
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