relax SVN archive

Changing the description in the user function load_spins().

In description of the funtion load_spins() in prompt/structure.py the example for loading all C atoms was changed from 'relax> structure.load_spins(spin_id='@C')' to relax> structure.load_spins(spin_id='@*C*').

The name of the analysis can now be changed in the new analysis wizard.

This is not propagated to the analyses yet.

Debugging the user function load_spins() and add_item().

In the function load_spins() in generic_fns/structure/main.py a parameter 'res_num_exist' was added to check whether in the structural data the residue number exists or not. Normally in the pdb file there is a residue number and in the xyz file not. And then this parameter was used as a flag in the add_item() to avoid the Error message 'RelaxError("The residue number '" + repr(res_num) + "' already exists in the sequence.")' in case for xyz file when residue number does not exist.

Debugging in the system_test test_read_xyz_internal2().

In the function to load a single spin, the sign for recognizing the molecule "#" was added and the second atom was loaded instead of loading all C atoms.

Debugging the user function fill_object_from_xyz()..

In the user function fill_object_from_xyz() in generic_fns/structure/internal.py the initialisation of the atom number was changed from 0 to 1.

Debugging in the system_test test_read_xyz_internal2().

In the function to load a single spin, the sign for recognizing the molecule "#" was added and the second atom was loaded instead of loading all C atoms.

Removed an incorrect comment.

The R1 and R2 analysis buttons in the new analysis wizard now display the new graphics.

Added graphics for the R2 analysis.

Added graphics for R1 relaxation.