URL: <http://gna.org/bugs/?20889> Summary: Multiple intensity columns from a Custom Peak intensity file, blocks the subsequent calls to GUI functions Project: relax Submitted by: tlinnet Submitted on: Tue 11 Jun 2013 10:45:03 AM GMT Category: relax's source code Severity: 4 - Important Priority: 5 - Normal Status: None Privacy: Public Assigned to: None Originator Name: Originator Email: Open/Closed: Open Discussion Lock: Any Release: Repository: trunk Operating System: None _______________________________________________________ Details: The multiple intensity column fix to bug: " https://gna.org/bugs/index.php?20873 " Made it possible to import several intensity columns, from the a generic file. But only to make the following auto-GUI steps not working. After loading intensities, the GUI continues with: 1) Spectrometer_frequency_setup 2) Relaxation_delay_time_setting 3) CPMG_frequency_setting These GUI'a are now not working, since they by default use the spectrum name which was least imported. And for a list of names, it then make a full string name: spectrum_id=['0_2', '1_0'] -> spectrometer.frequency(id="['0_2', '1_0']" One would be able with the buttons to skip: 1) Spectrometer_frequency_setup AND 2) Relaxation_delay_time_setting. But it is not possible to skip 3) CPMG_frequency_setting and so no import is possible. It is further not possible to set time=None in CPMG_frequency_setting. "None" is marking the pulse scheme without 180 refocus pulse, and is used as a reference for intensity proportionality. ------ relax> relax_disp.cpmg_frq(spectrum_id='3_0', cpmg_frq=u'None') File "/sbinlab2/software/NMR-relax/relax_disp/specific_analyses/relax_disp/disp_data.py", line 152, in cpmg_frq cdp.cpmg_frqs[spectrum_id] = float(cpmg_frq) ValueError: could not convert string to float: None ------ I suggest that step 1+2+3 is skipped during importing of intensity columns. A "setup check" button could then call step 1+2+3. A further wish would be the possible to assign and propagate settings to a multiple of intensity spectra, since they would highly likely be the same for a large fraction. Screenshots and log errors are provided in this reference: https://gna.org/bugs/index.php?20873 _______________________________________________________ Reply to this item at: <http://gna.org/bugs/?20889> _______________________________________________ Message sent via/by Gna! http://gna.org/