relax SVN archive

Initialized merge tracking via "svnmerge" with revisions "1-24540" from
svn+ssh://bugman@.../svn/relax/branches/zooming_grid_search

Fix for a bug introduced at r24689 in the parameter object units() method.

The unit string was accidentally being set to the function or method.

Expanded the documentation for the minimise.calculate user function.

This now explains the dual operations of the user function.

Modified the grid search upper bounds functions for the relaxation curve-fitting.

This is for both the exponential relaxation curve-fitting analysis and the same fitting in the
dispersion analysis. The intensity values are doubled and then rounded to the next order. This
ensures that I0 and Iinf will be within the grid bounds. Hence the zooming grid search can be used
for these curves.

Completed the Relax_fit.test_zooming_grid_search system test.

Now only a single spin is optimised. The zooming levels increase in integer increments from 0 to 50
so that the final zoomed grid is insanely small (as the curve-fitting C modules are incredibly fast,
this test is nevertheless relatively quick). The final zooming grid search parameter values are
checked to see if they are the same as those optimised in the Relax_fit.test_curve_fitting_height
system test to demonstrate the success of the algorithm.

Expanded the minimise.grid_zoom user function documentation.

A few sentences about the limitations of the algorithm have been added.

Large expansion of the minimise.grid_search user function documentation.

The previous documentation was essentially non-existent.

Alphabetical ordering of the minimisation user functions in the user_functions.minimisation module.

Changed the minimise.grid_zoom user function.

The zoom level can now be any floating point number or integer, including negative values. The user
function docstring has been significantly expanded to explain the entire zooming grid search
concept.

Removed a debugging printout.