mailr5456 - /1.3/sample_scripts/noe.py


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Posted by edward on April 08, 2008 - 18:20:
Author: bugman
Date: Tue Apr  8 18:20:00 2008
New Revision: 5456

URL: http://svn.gna.org/viewcvs/relax?rev=5456&view=rev
Log:
Updated the noe.py sample script to use the new structure.load_spins() user 
function.


Modified:
    1.3/sample_scripts/noe.py

Modified: 1.3/sample_scripts/noe.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/sample_scripts/noe.py?rev=5456&r1=5455&r2=5456&view=diff
==============================================================================
--- 1.3/sample_scripts/noe.py (original)
+++ 1.3/sample_scripts/noe.py Tue Apr  8 18:20:00 2008
@@ -4,8 +4,9 @@
 name = 'noe'
 pipe.create(name, 'noe')
 
-# Load the sequence from a PDB file.
-structure.read_pdb(name, 'Ap4Aase_new_3.pdb', load_seq=1)
+# Load the backbone amide 15N spins from a PDB file.
+structure.read_pdb('Ap4Aase_new_3.pdb')
+structure.load_spins(spin_id='@N')
 
 # Load the reference spectrum and saturated spectrum peak intensities.
 noe.read(name, file='ref.list', spectrum_type='ref')




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