mailr20957 - /trunk/user_functions/interatom.py


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Posted by edward on September 10, 2013 - 11:15:
Author: bugman
Date: Tue Sep 10 11:15:05 2013
New Revision: 20957

URL: http://svn.gna.org/viewcvs/relax?rev=20957&view=rev
Log:
Update of the description of the interatom.define user function.


Modified:
    trunk/user_functions/interatom.py

Modified: trunk/user_functions/interatom.py
URL: 
http://svn.gna.org/viewcvs/relax/trunk/user_functions/interatom.py?rev=20957&r1=20956&r2=20957&view=diff
==============================================================================
--- trunk/user_functions/interatom.py (original)
+++ trunk/user_functions/interatom.py Tue Sep 10 11:15:05 2013
@@ -145,7 +145,7 @@
 )
 # Description.
 uf.desc.append(Desc_container())
-uf.desc[-1].add_paragraph("To analyse relaxation or residual dipolar 
coupling (RDC) data, for example, pairs of spins which are coupled via the 
magnetic dipole-dipole interaction need to be defined.  This function will 
create an interatomic data object connecting two existing spins.  This data 
container will be used to store all all information about the interactomic 
interaction including interatomic vectors and distances.")
+uf.desc[-1].add_paragraph("To analyse relaxation or residual dipolar 
coupling (RDC) data, for example, pairs of spins which are coupled need to be 
defined.  This can be via the magnetic dipole-dipole interaction or scalar 
coupling interaction.  This function will create an interatomic data object 
connecting two existing spins.  This data container will be used to store all 
information about the interactomic interaction including interatomic vectors 
and distances.")
 uf.desc[-1].add_paragraph("For analyses which use relaxation data, simply 
defining the interatomic interaction will indicate that there is a dipolar 
relaxation mechanism operating between the two spins.  Note that for 
model-free analyses or reduced spectral density mapping, only a single 
relaxation mechanism can be handled.  For RDC dependent analyses, the 
presence of the interatomic interaction indicates that dipolar coupling is 
expected between the two spins.")
 # Prompt examples.
 uf.desc.append(Desc_container("Prompt examples"))




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