mailr11213 - /branches/bieri_gui/gui_bieri/analyses/auto_model_free.py


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Posted by michael . bieri on May 24, 2010 - 02:58:
Author: michaelbieri
Date: Mon May 24 02:58:44 2010
New Revision: 11213

URL: http://svn.gna.org/viewcvs/relax?rev=11213&view=rev
Log:
Number of maximum iterations is included in executing dauvergne_protocol.py.

Modified:
    branches/bieri_gui/gui_bieri/analyses/auto_model_free.py

Modified: branches/bieri_gui/gui_bieri/analyses/auto_model_free.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/bieri_gui/gui_bieri/analyses/auto_model_free.py?rev=11213&r1=11212&r2=11213&view=diff
==============================================================================
--- branches/bieri_gui/gui_bieri/analyses/auto_model_free.py (original)
+++ branches/bieri_gui/gui_bieri/analyses/auto_model_free.py Mon May 24 
02:58:44 2010
@@ -618,6 +618,9 @@
         # Results directory.
         data.save_dir = self.data.results_dir_model
 
+        # Number of maximum iterations.
+        data.max_iter = self.data.max_iter
+
         # Return the container.
         return data
 
@@ -851,7 +854,7 @@
         time.sleep(0.5)
 
         # Start the protocol.
-        dAuvergne_protocol(save_dir=data.save_dir, diff_model=global_model, 
mf_models=data.mf_models, local_tm_models=data.local_tm_models, 
pdb_file=data.structure_file, seq_args=data.seq_args, het_name=data.het_name, 
relax_data=data.relax_data, unres=data.unres, exclude=data.exclude, 
bond_length=data.bond_length, csa=data.csa, hetnuc=data.hetnuc, 
proton=data.proton, grid_inc=data.inc, min_algor=data.min_algor, 
mc_num=data.mc_num, conv_loop=data.conv_loop)
+        dAuvergne_protocol(save_dir=data.save_dir, diff_model=global_model, 
mf_models=data.mf_models, local_tm_models=data.local_tm_models, 
pdb_file=data.structure_file, seq_args=data.seq_args, het_name=data.het_name, 
relax_data=data.relax_data, unres=data.unres, exclude=data.exclude, 
bond_length=data.bond_length, csa=data.csa, hetnuc=data.hetnuc, 
proton=data.proton, grid_inc=data.inc, min_algor=data.min_algor, 
mc_num=data.mc_num, max_iter=data.max_iter, conv_loop=data.conv_loop)
 
         # Feedback about success.
         wx.CallAfter(self.gui.controller.log_panel.AppendText, 
'\n\n__________________________________________________________\n\nSuccessfully
 calculated '+global_model+' 
Model\n__________________________________________________________')




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