Re: Rex in the BMRB

2011-03-09 Thread Edward d'Auvergne
Hi, That's ok. Seb and I are still working out what is necessary. I think the most important new tag would be something like: _Order_parameter_list.Rex_frequency_1H as then the Rex values will make sense. The Rex value changes quadratically with field strength (this is the assumption in a

[bug #17876] relax_fit script failing

2011-03-09 Thread anonymous
URL: http://gna.org/bugs/?17876 Summary: relax_fit script failing Project: relax Submitted by: None Submitted on: Wed 09 Mar 2011 02:35:45 PM UTC Category: relax sample scripts Severity: 3 - Normal

Re: [bug #17876] relax_fit script failing

2011-03-09 Thread Edward d'Auvergne
Hi, I've just tested out the script and peak height file, and all seems to be ok. All of the intensities have been read into relax. There are 3 that are skipped though. One of these NMRView lines looks like: 18 {} 9.27778 0.02133 0.02569 ++ {0.0} {} {} 118.21079 0.19138 0.23045 ++ {0.0} {}

Fwd: [bug #17876] relax_fit script failing

2011-03-09 Thread Elio Cino
-- Forwarded message -- From: Elio Cino herfw...@gmail.com Date: Wed, Mar 9, 2011 at 10:20 AM Subject: Re: [bug #17876] relax_fit script failing To: Edward d'Auvergne edw...@nmr-relax.com Hello. I realize that those peaks are not labelled. They were unassigned residues. In the