Oh, the truncated versions of the peak lists should only contain ~2 spins. These spins should be the best representation of the model.
Regards, Edward On 3 September 2013 13:29, Edward d'Auvergne <[email protected]> wrote: > I would suggest the following: > > - Come up with a directory name for the test data. Ask for this to be > created, with a commit message. I don't know how well git-svn handles > this part, so I can create it for you. Lets try with git-svn and see > what happens. > > - Attach the peak lists to the support request > (http://gna.org/support/?3071) and ask to have them added to the > directory (with commit message). We can try with git-svn, i.e. you > add the files, but maybe I have to do that for you with pure svn. > > - Make truncated versions of these files (ending in _trunc.*) and add these. > > - Add a script which performs the full analysis in relax for the > model. Also a script which performs the analysis using only the R2eff > model. See the test_suite/shared_data/dispersion/Hansen/*.py scripts > for reference - these scripts can even be copied to your data > directory and modified. > > - Copy the full analysis script to > test_suite/system_tests/scripts/relax_disp/ with an appropriate name. > This can then be used in a new system test. > > Regards, > > Edward > > > > > On 3 September 2013 12:59, Troels Emtekær Linnet <[email protected]> wrote: >> Should I then make a state file with the pipes 'R2eff', 'No Rex' and >> then delete or deselect spins, >> before saving. >> >> And then make a test which loads this saved state, and minimise? >> >> Best >> Troels >> >> Troels Emtekær Linnet >> >> >> 2013/9/3 Edward d'Auvergne <[email protected]>: >>> I'm still getting the test suite to be happy on MS Windows. I'll look >>> into this soon. I think that the kA parameter should be renamed as >>> k_AB throughout. It is also missing from the table in the relax >>> manual. You should now also be looking at getting some of your >>> dispersion data into the relax test suite and to set up a system test >>> (which is the tests you have been running, but restricted to 1-2 >>> spins). >>> >>> Regards, >>> >>> Edward >>> >>> On 3 September 2013 09:59, Troels Emtekær Linnet <[email protected]> wrote: >>>> With these patches I am know able to run an analysis with the TSMFK01 as >>>> model. >>>> >>>> I am now looking into the results of this run, and compare to the article. >>>> >>>> >>>> >>>> >>>> Troels Emtekær Linnet >>>> >>>> >>>> 2013/9/3 Troels E. Linnet <[email protected]> >>>> >>>>> Follow-up Comment #17, sr #3071 (project relax): >>>>> >>>>> Renaming ka to kA, and fixing the extraction of parameters. >>>>> >>>>> (file #18838) >>>>> _______________________________________________________ >>>>> >>>>> Additional Item Attachment: >>>>> >>>>> File name: fix.patch.tar.gz Size:1 KB >>>>> >>>>> >>>>> _______________________________________________________ >>>>> >>>>> Reply to this item at: >>>>> >>>>> <http://gna.org/support/?3071> >>>>> >>>>> _______________________________________________ >>>>> Message sent via/by Gna! >>>>> http://gna.org/ >>>>> >>>> _______________________________________________ relax (http://www.nmr-relax.com) This is the relax-devel mailing list [email protected] To unsubscribe from this list, get a password reminder, or change your subscription options, visit the list information page at https://mail.gna.org/listinfo/relax-devel
