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→Background: Link fixes and use of a. New template.
== Background ==
This follow the discussion with Sam Mahdi, at the mailing list: https://mail.{{gna.org/public/mailing list url|relax-users/2016-09/threads.html#00001}}
Files has been uploaded to: {{gna bug #25044: https://gna.org/bugs/?link|25044}}
* Model Free Analysis problems when attempting to run on multi-processors and using the script to run
== Version of relax and computer ==
Version og of relax is 4.0.2
<source lang="text">
<source lang="python">
structure.read_pdb('2d9j.pdb', set_mol_name='hRGS7', read_model=1)
</source>
value.set(-172 * 1e-6, 'csa', spin_id='@N*')
</source>
=== Start relax in GUI ===
<source lang="bash">
relax -g -t log_gui.txt
</source>
Now do
# File -> New analysis
# Select "Model-free" -> Next
# Just hit Start in the box for pipe name
# Goto "User functions (n-z)" -> Script
# Find and open the script file "sam_script_GUI.py"
This should now fill out the data. Inspect the data
# View -> Spin Viewer
Save the state before execution. This state is easy to load in the GUI afterward
# File -> Save relax state -> as "test.bz2"
Exit relax. And start relax again
<source lang="bash">
relax -g -t log_gui_2.txt
</source>
Now do
# File -> Open relax state
# Select "test.bz2"
It should now show all the data.
Hit "Execute"
Consider
# Setting the number of Monte-Carlo simulations to 10, for initial faster calculation
== Conclusion ==
== See also ==
[[Category:Tutorials]]
[[Category:Relaxation dispersion analysisModel-free_analysis]]