URL: <http://gna.org/bugs/?20683> Summary: relaxerror in dauvergne_protocol.py Project: relax Submitted by: None Submitted on: Fri 29 Mar 2013 05:07:38 PM UTC Category: relax sample scripts Severity: 3 - Normal Priority: 5 - Normal Status: None Privacy: Public Assigned to: None Originator Name: Originator Email: mengjun.xue@xxxxxxxxxxxxxxxxxxxx Open/Closed: Open Discussion Lock: Any Release: 2.2.5 Operating System: Microsoft Windows _______________________________________________________ Details: Hi Edward, I am using dauvergne_protocol.py to analyse my nmr data (500 MHz and 700 MHz)under relax 2.2.5, the program run smoothly at beginning, which has been ran overnight, but the program stopped at RelaxError:The invalid chi-squared floating point value of NaN (Not a Number) as occurred. Could you please tell what is the problem? Please find attached files. Thank you. Regards, Mengjun _______________________________________________________ File Attachments: ------------------------------------------------------- Date: Fri 29 Mar 2013 05:07:38 PM UTC Name: 2QFK_MONOMERHabc5.pdb Size: 283kB By: None <http://gna.org/bugs/download.php?file_id=17593> ------------------------------------------------------- Date: Fri 29 Mar 2013 05:07:38 PM UTC Name: dauvergne_protocol.py Size: 12kB By: None <http://gna.org/bugs/download.php?file_id=17594> ------------------------------------------------------- Date: Fri 29 Mar 2013 05:07:38 PM UTC Name: T1 dhp 500.txt Size: 62kB By: None <http://gna.org/bugs/download.php?file_id=17595> ------------------------------------------------------- Date: Fri 29 Mar 2013 05:07:38 PM UTC Name: T1 dhp 700.txt Size: 75kB By: None <http://gna.org/bugs/download.php?file_id=17596> _______________________________________________________ Reply to this item at: <http://gna.org/bugs/?20683> _______________________________________________ Message sent via/by Gna! http://gna.org/