mailr17262 - /branches/frame_order_testing/user_functions/frame_order.py


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Posted by edward on July 17, 2012 - 09:26:
Author: bugman
Date: Tue Jul 17 09:26:39 2012
New Revision: 17262

URL: http://svn.gna.org/viewcvs/relax?rev=17262&view=rev
Log:
Reimplementation of r15046 but within the auto-generated user function design.

The 'fix' flag of the frame_order.pivot user function was lost as the changes 
went into
prompt/frame_order.py.

.....
  r15046 | bugman | 2011-12-07 18:04:11 +0100 (Wed, 07 Dec 2011) | 5 lines
  Changed paths:
     M /branches/frame_order_testing/prompt/frame_order.py
     M /branches/frame_order_testing/specific_fns/frame_order.py
  
  The frame_order.pivot user function now accepts the fix argument to allow 
the pivot to be fixed.
  
  This is for optimisation.
.....


Modified:
    branches/frame_order_testing/user_functions/frame_order.py

Modified: branches/frame_order_testing/user_functions/frame_order.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/frame_order_testing/user_functions/frame_order.py?rev=17262&r1=17261&r2=17262&view=diff
==============================================================================
--- branches/frame_order_testing/user_functions/frame_order.py (original)
+++ branches/frame_order_testing/user_functions/frame_order.py Tue Jul 17 
09:26:39 2012
@@ -135,6 +135,12 @@
     dim = 3,
     desc_short = "pivot point",
     desc = "The pivot point for the motion (e.g. the position between the 2 
domains in PDB coordinates)."
+)
+uf.add_keyarg(
+    name = "fix",
+    py_type = "bool",
+    desc_short = "fixed flag",
+    desc = "A flag specifying if the pivot point should be fixed during 
optimisation."
 )
 # Description.
 uf.desc.append(Desc_container())




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