URL: <http://gna.org/bugs/?12607> Summary: RelaxError: Grid search size too large Project: relax Submitted by: None Submitted on: Tuesday 11/18/2008 at 00:28 CET Category: relax's source code Severity: 3 - Normal Priority: 5 - Normal Status: None Privacy: Public Assigned to: None Originator Name: Chris Brosey Originator Email: chris.a.brosey@xxxxxxxxxxxxxx Open/Closed: Open Discussion Lock: Any Release: Repository: 1.3 line Operating System: GNU/Linux _______________________________________________________ Details: Greetings, In running the full_analysis.py script for the ‘sphere’ model, I have encountered an error during optimization of the diffusion tensor, primarily that the size of the grid search is too large (see attached traceback and output logs). I am using experimental input data of my own (~246 residues) that has been formatted to match the test files that I have used previously. The only alteration to the script after a successful ‘local_tm’ run was to specify ‘sphere’ as the diffusion model. This error does not occur when I run the test files from /test_suite/shared_data/model_free/S2…0.149, so I am not sure what is going on. The reference pdb I am using is the output of the Palmer r2r1_diffusion script. I am attaching two files: (1) Traceback.log with output from the --debug option and (2) relax_sphere.log with general output from the run. Many thanks! _______________________________________________________ File Attachments: ------------------------------------------------------- Date: Tuesday 11/18/2008 at 00:28 CET Name: Traceback.log Size: 2kB By: None <http://gna.org/bugs/download.php?file_id=5018> ------------------------------------------------------- Date: Tuesday 11/18/2008 at 00:28 CET Name: relax_sphere.log Size: 36kB By: None <http://gna.org/bugs/download.php?file_id=5019> _______________________________________________________ Reply to this item at: <http://gna.org/bugs/?12607> _______________________________________________ Message sent via/by Gna! http://gna.org/