mailr17533 - /trunk/sample_scripts/model_free/dauvergne_protocol.py


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Posted by edward on September 20, 2012 - 17:46:
Author: bugman
Date: Thu Sep 20 17:46:26 2012
New Revision: 17533

URL: http://svn.gna.org/viewcvs/relax?rev=17533&view=rev
Log:
Fixed the dipole_pair.define user function calls in the dauvergne_protocol.py 
sample script.

This is a recently introduced problem only present in the trunk.


Modified:
    trunk/sample_scripts/model_free/dauvergne_protocol.py

Modified: trunk/sample_scripts/model_free/dauvergne_protocol.py
URL: 
http://svn.gna.org/viewcvs/relax/trunk/sample_scripts/model_free/dauvergne_protocol.py?rev=17533&r1=17532&r2=17533&view=diff
==============================================================================
--- trunk/sample_scripts/model_free/dauvergne_protocol.py (original)
+++ trunk/sample_scripts/model_free/dauvergne_protocol.py Thu Sep 20 17:46:26 
2012
@@ -211,7 +211,8 @@
 deselect.read(file='exclude', spin_id_col=1)
 
 # Define the magnetic dipole-dipole relaxation interaction.
-dipole_pair.define(spin_id1='@N*', spin_id2='@H*', direct_bond=True)
+dipole_pair.define(spin_id1='@N', spin_id2='@H', direct_bond=True)
+dipole_pair.define(spin_id1='@NE1', spin_id2='@HE1', direct_bond=True)
 dipole_pair.set_dist(spin_id1='@N*', spin_id2='@H*', ave_dist=1.02 * 1e-10)
 dipole_pair.unit_vectors()
 




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