r6880 - /branches/rdc_analysis/specific_fns/n_state_model.py -- July 09, 2008 - 16:07

Author: bugman
Date: Wed Jul  9 15:05:46 2008
New Revision: 6880

URL: http://svn.gna.org/viewcvs/relax?rev=6880&view=rev
Log:
Modified minimise_setup_rdcs() to throw a warning if RDCs exist but XH bond 
vectors are missing.


Modified:
    branches/rdc_analysis/specific_fns/n_state_model.py

Modified: branches/rdc_analysis/specific_fns/n_state_model.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/rdc_analysis/specific_fns/n_state_model.py?rev=6880&r1=6879&r2=6880&view=diff
==============================================================================
--- branches/rdc_analysis/specific_fns/n_state_model.py (original)
+++ branches/rdc_analysis/specific_fns/n_state_model.py Wed Jul  9 15:05:46 
2008
@@ -711,7 +711,12 @@
                 continue
 
             # Skip spins without RDC data or unit XH bond vectors.
-            if not hasattr(spin, 'rdc') or not hasattr(spin, 'xh_vect'):
+            if not hasattr(spin, 'rdc'):
+                continue
+
+            # RDC data exists but the XH bond vectors are missing?
+            if not hasattr(spin, 'xh_vect'):
+                warn(RelaxWarning("RDC data exists but the XH bond vectors 
are missing, skipping spin " + spin_id))
                 continue
 
             # Append the RDC and XH vectors to the lists.