Author: bugman
Date: Sun Sep 14 15:07:22 2014
New Revision: 25832
URL: http://svn.gna.org/viewcvs/relax?rev=25832&view=rev
Log:
Fix for the frame_order.count_sobol_points user function for the rigid model.
This model is now caught at the start, a message printed out, and the function
exited.
Modified:
branches/frame_order_cleanup/specific_analyses/frame_order/optimisation.py
Modified:
branches/frame_order_cleanup/specific_analyses/frame_order/optimisation.py
URL:
http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/specific_analyses/frame_order/optimisation.py?rev=25832&r1=25831&r2=25832&view=diff
==============================================================================
--- branches/frame_order_cleanup/specific_analyses/frame_order/optimisation.py
(original)
+++ branches/frame_order_cleanup/specific_analyses/frame_order/optimisation.py
Sun Sep 14 15:07:22 2014
@@ -59,7 +59,7 @@
"""
# Printout.
- print("Sobol' integration point counting for the current parameter
values.")
+ print("Sobol' quasi-random integration point counting for the current
parameter values.")
# Checks.
if not check_model(escalate=1):
@@ -67,6 +67,11 @@
if not check_parameters(escalate=1):
return
if not check_domain(escalate=1):
+ return
+
+ # Handle the rigid model.
+ if cdp.model == MODEL_RIGID:
+ print("\nSobol' quasi-random integration points are not used for the
rigid frame order model.")
return
# Set up the data structures for the target function.
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