Author: tlinnet
Date: Fri Aug 29 12:10:17 2014
New Revision: 25426
URL: http://svn.gna.org/viewcvs/relax?rev=25426&view=rev
Log:
Increased the number of time points for exponential curve fitting to 3.
Modified:
trunk/specific_analyses/relax_disp/optimisation.py
Modified: trunk/specific_analyses/relax_disp/optimisation.py
URL:
http://svn.gna.org/viewcvs/relax/trunk/specific_analyses/relax_disp/optimisation.py?rev=25426&r1=25425&r2=25426&view=diff
==============================================================================
--- trunk/specific_analyses/relax_disp/optimisation.py (original)
+++ trunk/specific_analyses/relax_disp/optimisation.py Fri Aug 29 12:10:17 2014
@@ -381,11 +381,11 @@
times.append(time)
# Raise errors if number of time points is less than 2.
- if len(times) < 2:
+ if len(times) < 3:
subsection(file=sys.stdout, text="Exponential curve fitting
error for point:", prespace=2)
point_info = "%s at %3.1f MHz, for offset=%3.3f ppm and
dispersion point %-5.1f, with %i time points." % (exp_type, frq/1E6, offset,
point, len(times))
print(point_info)
- raise RelaxError("The data setup points to exponential curve
fitting, but only %i time points was found. If calculating R2eff values for
fixed relaxation time period data, check that a reference intensity has been
specified for each offset value."%(len(times)))
+ raise RelaxError("The data setup points to exponential curve
fitting, but only %i time points was found, where 3 time points is minimum. If
calculating R2eff values for fixed relaxation time period data, check that a
reference intensity has been specified for each offset value."%(len(times)))
# The scaling matrix in a diagonalised list form.
scaling_list = []
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