Hi, Thank you for the bug report (https://gna.org/bugs/index.php?17457). This is now fixed in the 1.3 repository line. I will try to release a new version of relax due to the more important diffusion tensor bug that Vitaly Vostrikov found (which is also now fixed).
Cheers, Edward On 7 January 2011 16:06, Maddy Strickland <[email protected]> wrote: > Hi Edward, > > I've been using the 1.3.6. version of Relax today. It is excellent at > recognising the Analysis2.1 Sparky formatted files now, thank you Edward, > but I thought I might try using my old lists and changing the int_method > function in Relax curve fit from 'height' to 'volume' (as they were volume > all along!) to see what answers I get - will it get me accurated results - > in the manual, it says that error is calculated in the same way as long > as you have replicated spectra for either height or volume - is this true? > > Apart from these queries I think I've come across a problem... In the test > suite, using 'height' as the in_method function, there are no problems. > But when you change to 'point_sum' or 'point sum' as it says in the manual > (tried both), the program says the options are height, volume or other. > I've tried putting in 'volume', but I get the following error. > > > ----------------------------- > relax> spectrum.replicated(spectrum_ids=['T2_ncyc1_ave', 'T2_ncyc1b_ave']) > > relax> spectrum.replicated(spectrum_ids=['T2_ncyc4_ave', 'T2_ncyc4b_ave']) > > relax> spectrum.replicated(spectrum_ids=['T2_ncyc9_ave', 'T2_ncyc9b_ave']) > > relax> spectrum.replicated(spectrum_ids=['T2_ncyc11_ave', 'T2_ncyc11b_ave']) > > relax> spectrum.error_analysis() > Intensity measure: Peak volumes. > Replicated spectra: Yes. > RelaxError: This function has not yet been implemented. > > ----------------------------- > > Is this a problem from changing between 'point sum' and 'volume' > nomenclature at some point? > > Madeleine Strickland > > MCJC Group > N317, School of Chemistry, Bristol University > > > _______________________________________________ > relax (http://nmr-relax.com) > > This is the relax-users 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-users > _______________________________________________ relax (http://nmr-relax.com) This is the relax-users 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-users
