r6798 - /1.3/generic_fns/angles.py -- July 07, 2008 - 16:07

Author: bugman
Date: Mon Jul  7 15:20:59 2008
New Revision: 6798

URL: http://svn.gna.org/viewcvs/relax?rev=6798&view=rev
Log:
Reverted all bond_vector references to xh_vector.


Modified:
    1.3/generic_fns/angles.py

Modified: 1.3/generic_fns/angles.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/generic_fns/angles.py?rev=6798&r1=6797&r2=6798&view=diff
==============================================================================
--- 1.3/generic_fns/angles.py (original)
+++ 1.3/generic_fns/angles.py Mon Jul  7 15:20:59 2008
@@ -82,7 +82,7 @@
     # Spin loop.
     for spin, mol_name, res_num, res_name in spin_loop(full_info=True):
         # Test if the vector exists.
-        if not hasattr(spin, 'bond_vect'):
+        if not hasattr(spin, 'xh_vect'):
             # Get the spin id string.
             spin_id = generate_spin_id(mol_name, res_num, res_name, 
spin.num, spin.name)
 
@@ -93,8 +93,8 @@
             continue
 
         # dz and dx direction cosines.
-        dz = dot(Dz, spin.bond_vect)
-        dx = dot(Dx, spin.bond_vect)
+        dz = dot(Dz, spin.xh_vect)
+        dx = dot(Dx, spin.xh_vect)
 
         # Calculate the polar angle theta.
         spin.theta = acos(dz)
@@ -112,7 +112,7 @@
     # Loop over the sequence.
     for spin, mol_name, res_num, res_name in spin_loop(full_info=True):
         # Test if the vector exists.
-        if not hasattr(spin, 'bond_vect'):
+        if not hasattr(spin, 'xh_vect'):
             # Get the spin id string.
             spin_id = generate_spin_id(mol_name, res_num, res_name, 
spin.num, spin.name)
 
@@ -123,7 +123,7 @@
             continue
 
         # Calculate alpha.
-        spin.alpha = acos(dot(cdp.diff_tensor.Dpar_unit, spin.bond_vect))
+        spin.alpha = acos(dot(cdp.diff_tensor.Dpar_unit, spin.xh_vect))
 
 
 def wrap_angles(angle, lower, upper):