r9788 - /branches/bmrb/specific_fns/model_free/bmrb.py -- October 26, 2009 - 18:19

Author: bugman
Date: Mon Oct 26 18:19:18 2009
New Revision: 9788

URL: http://svn.gna.org/viewcvs/relax?rev=9788&view=rev
Log:
relax now places the isotope number into the BMRB file.


Modified:
    branches/bmrb/specific_fns/model_free/bmrb.py

Modified: branches/bmrb/specific_fns/model_free/bmrb.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/bmrb/specific_fns/model_free/bmrb.py?rev=9788&r1=9787&r2=9788&view=diff
==============================================================================
--- branches/bmrb/specific_fns/model_free/bmrb.py (original)
+++ branches/bmrb/specific_fns/model_free/bmrb.py Mon Oct 26 18:19:18 2009
@@ -250,7 +250,7 @@
                 software_id = software_ids[i]
 
         # Generate the model-free data saveframe.
-        star.model_free.add(global_chi2=global_chi2, 
software_ids=[software_id], software_labels=['relax'], res_nums=res_num_list, 
res_names=res_name_list, atom_names=atom_name_list, atom_types=element_list, 
local_tc=local_tm_list, s2=s2_list, s2f=s2f_list, s2s=s2s_list, te=te_list, 
tf=tf_list, ts=ts_list, rex=rex_list, local_tc_err=local_tm_err_list, 
s2_err=s2_err_list, s2f_err=s2f_err_list, s2s_err=s2s_err_list, 
te_err=te_err_list, tf_err=tf_err_list, ts_err=ts_err_list, 
rex_err=rex_err_list, rex_frq=rex_frq, chi2=chi2_list, model_fit=model_list)
+        star.model_free.add(global_chi2=global_chi2, 
software_ids=[software_id], software_labels=['relax'], res_nums=res_num_list, 
res_names=res_name_list, atom_names=atom_name_list, atom_types=element_list, 
isotope=isotope_list, local_tc=local_tm_list, s2=s2_list, s2f=s2f_list, 
s2s=s2s_list, te=te_list, tf=tf_list, ts=ts_list, rex=rex_list, 
local_tc_err=local_tm_err_list, s2_err=s2_err_list, s2f_err=s2f_err_list, 
s2s_err=s2s_err_list, te_err=te_err_list, tf_err=tf_err_list, 
ts_err=ts_err_list, rex_err=rex_err_list, rex_frq=rex_frq, chi2=chi2_list, 
model_fit=model_list)
 
 
         # Write the contents to the STAR formatted file.