URL:
<http://gna.org/bugs/?19717>
Summary: relax_fit.py: write.grace, deselect.read parameters
Project: relax
Submitted by: mab
Submitted on: Mon 07 May 2012 09:19:50 AM GMT
Category: relax sample scripts
Severity: 3 - Normal
Priority: 5 - Normal
Status: None
Privacy: Public
Assigned to: None
Originator Name:
Originator Email:
Open/Closed: Open
Discussion Lock: Any
Release: 1.3.15
Operating System: Mac OS X (Intel)
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Details:
I noticed that in the sample script relax_fit.py some parameters need to be
updated:
* in write.grace: y_data_type needs to be 'intensities' instead of 'int',
otherwise relax complains
* deselect.read needs the res_num_col specified, otherwise relax complains:
"RelaxError: The identifier '' corresponds to more than a single spin in the
'rx' data pipe."
All of this can be found via the help function however.
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