Author: michaelbieri
Date: Wed Feb 24 06:09:15 2010
New Revision: 10901
URL: http://svn.gna.org/viewcvs/relax?rev=10901&view=rev
Log:
The function execute_thread() originally copied from auto_rx_base.py was
adapted to execute NOE analysis.
Modified:
branches/bieri_gui/gui_bieri/analyses/auto_noe.py
Modified: branches/bieri_gui/gui_bieri/analyses/auto_noe.py
URL:
http://svn.gna.org/viewcvs/relax/branches/bieri_gui/gui_bieri/analyses/auto_noe.py?rev=10901&r1=10900&r2=10901&view=diff
==============================================================================
--- branches/bieri_gui/gui_bieri/analyses/auto_noe.py (original)
+++ branches/bieri_gui/gui_bieri/analyses/auto_noe.py Wed Feb 24 06:09:15
2010
@@ -495,7 +495,7 @@
sys.stderr = redir
# Print a header in the controller.
- header = 'Starting %s calculation' % self.label
+ header = 'Starting NOE calculation'
underline = '-' * len(header)
wx.CallAfter(self.gui.controller.log_panel.AppendText,
(header+'\n\n'))
time.sleep(0.5)
@@ -504,7 +504,7 @@
data = self.assemble_data()
# Execute.
- Relax_fit(seq_args=data.seq_args, file_names=data.file_names,
relax_times=data.relax_times, int_method=data.int_method,
mc_num=data.mc_num, pdb_file = data.structure_file, unresolved =
data.unresolved)
+ NOE_calc(pipe_name='noe', noe_ref = data.ref_file, noe_ref_rmsd =
data.ref_rmsd, noe_sat = data.sat_file, noe_sat_rmsd = data.sat_rmsd, freq
= data.frq, unresolved = data.unresolved, pdb_file = data.structure_file,
results_folder = data.save_dir, int_method='height', mc_num=500)
def link_data(self, data):
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