Edward, thank you, I think I overcame this hurdle and loaded the spins and the
heteronuclear NOE Dynamics Center file with no problem.
However, when I try to repeat the procedure using the T1 DC file, the software
(4.1.1) hangs up. In particular, a clock icon appears, in place of the arrow,
upon me clicking on the “next” button, and nothing else happens.
As a follow up, IMHO it is not clear, in the GUI, when one has to click on
“apply” or “next”. For example, upon loading the spins from the PDB file, after
selecting the “load spin from PDB option” and indicating the filename of the
PDB file (without the # symbol, thanks), if I click on “apply” and then on
“next”, I load the same molecule twice. Maybe it would be more logical to have
the “apply” button only when it is needed (for example upon loading the
different types of nuclei, @N and @H, for example) but hide it or make it
inactive when only the “next” option should be used.
Best,
Stefano
On 13 Mar 2019, at 09:55, Edward d'Auvergne
<[email protected]<mailto:[email protected]>>
wrote:
Note that you can simply name your molecule differently via the
structure.read_pdb user function.
________________________________
[tickets:#12]<https://sourceforge.net/p/nmr-relax/tickets/12/> Error message
upon loading PDB file - NEW
Status: open
Created: Fri Mar 08, 2019 02:59 PM UTC by Stefano Ciurli
Last Updated: Wed Mar 13, 2019 08:55 AM UTC
Owner: Edward d'Auvergne
Attachments:
*
NewRelaxBug.jpg<https://sourceforge.net/p/nmr-relax/tickets/12/attachment/NewRelaxBug.jpg>
(90.9 kB; image/jpeg)
Hello, it seems that the problem of loading the spins from a PDB file has not
been fully resolved. Please help.
SC
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** [tickets:#12] Error message upon loading PDB file - NEW**
**Status:** fixed
**Labels:** structure
**Created:** Fri Mar 08, 2019 02:59 PM UTC by Stefano Ciurli
**Last Updated:** Wed Mar 13, 2019 09:47 AM UTC
**Owner:** Edward d'Auvergne
**Attachments:**
-
[NewRelaxBug.jpg](https://sourceforge.net/p/nmr-relax/tickets/12/attachment/NewRelaxBug.jpg)
(90.9 kB; image/jpeg)
Hello, it seems that the problem of loading the spins from a PDB file has not
been fully resolved. Please help.
SC
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