r5076 - /1.3/generic_fns/structure.py -- February 21, 2008 - 09:57

Author: bugman
Date: Thu Feb 21 09:57:46 2008
New Revision: 5076

URL: http://svn.gna.org/viewcvs/relax?rev=5076&view=rev
Log:
Updated the write_pdb_file() to accept the atomic_data object as an argument.


Modified:
    1.3/generic_fns/structure.py

Modified: 1.3/generic_fns/structure.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/generic_fns/structure.py?rev=5076&r1=5075&r2=5076&view=diff
==============================================================================
--- 1.3/generic_fns/structure.py (original)
+++ 1.3/generic_fns/structure.py Thu Feb 21 09:57:46 2008
@@ -1173,7 +1173,7 @@
     return vectors
 
 
-def write_pdb_file(file):
+def write_pdb_file(atomic_data, file):
     """Function for creating a PDB file from the given data.
 
     Introduction
@@ -1403,10 +1403,10 @@
 
 
 
-
-    @param file:    The PDB file object.  This object must be writable.
-    @type file:     file object
-    @return:        None
+    @param atomic_data: The dictionary containing the atomic data.
+    @type atomic_data:  dict
+    @param file:        The PDB file object.  This object must be writable.
+    @type file:         file object
     """
 
     # Sort the atoms.