relax SVN archive

Merged revisions 8014 via svnmerge from
svn+ssh://bugman@.../svn/relax/1.3

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r8014 | bugman | 2008-11-21 18:35:42 +0100 (Fri, 21 Nov 2008) | 3 lines

The structure.load_spins() user function now tests if a structure has been loaded.
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The structure.load_spins() user function now tests if a structure has been loaded.

Initialisation of the error_analysis() function.

Initialized merge tracking via "svnmerge" with revisions "1-8010" from
svn+ssh://bugman@.../svn/relax/1.3

Creation of a branch for the development of a J-coupling dynamics analysis.

This branch will be developed by Han Sun (hasu att nmr dot mpibpc dot mpg dot de), initially by
patch submission.

This code will form part of the N-state model dynamics analysis already within relax, and will be
useful for future dynamics analyses using dynamically averaged J-couplings.

Added the spectrum.error_analysis() user fn call to both the NOE sample script and system test.

Updated the NOE overfit_deselect() method to use RelaxDeselectWarning.

Deselected spins are skipped and the checks are now in an if-elif block.

Created a new warning class, RelaxDeselectWarning.

This is to be used by all overfit_deselect methods!

Modified the NOE overfit_deselect() for the new peak intensity data structures.

Added some tests to the NOE calculate() method.