r5511 - /1.3/generic_fns/structure/geometric.py -- April 09, 2008 - 17:22

Author: bugman
Date: Wed Apr  9 17:22:32 2008
New Revision: 5511

URL: http://svn.gna.org/viewcvs/relax?rev=5511&view=rev
Log:
Replaced the initialisation of the atomic_data dictionary with an instance of 
Internal_PDB.


Modified:
    1.3/generic_fns/structure/geometric.py

Modified: 1.3/generic_fns/structure/geometric.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/generic_fns/structure/geometric.py?rev=5511&r1=5510&r2=5511&view=diff
==============================================================================
--- 1.3/generic_fns/structure/geometric.py (original)
+++ 1.3/generic_fns/structure/geometric.py Wed Apr  9 17:22:32 2008
@@ -175,8 +175,8 @@
     else:
         pipes = [relax_data_store.current_pipe]
 
-    # Initialise the atom and atomic connections data structures.
-    atomic_data = {}
+    # Create the structural object.
+    structure = Internal_PDB()
 
     # Loop over the pipes.
     for pipe_index in xrange(len(pipes)):
@@ -351,8 +351,8 @@
     # Initialise.
     #############
 
-    # Initialise the atom and atomic connections data structures.
-    atomic_data = {}
+    # Create the structural object.
+    structure = Internal_PDB()
 
     # Initialise the residue number.
     res_num = 1