mailr11244 - in /1.3/generic_fns: pcs.py rdc.py


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Posted by edward on June 15, 2010 - 16:56:
Author: bugman
Date: Tue Jun 15 16:56:43 2010
New Revision: 11244

URL: http://svn.gna.org/viewcvs/relax?rev=11244&view=rev
Log:
The RDC and PCS correlation plots now also show the experimental errors.


Modified:
    1.3/generic_fns/pcs.py
    1.3/generic_fns/rdc.py

Modified: 1.3/generic_fns/pcs.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/generic_fns/pcs.py?rev=11244&r1=11243&r2=11244&view=diff
==============================================================================
--- 1.3/generic_fns/pcs.py (original)
+++ 1.3/generic_fns/pcs.py Tue Jun 15 16:56:43 2010
@@ -158,7 +158,7 @@
     data = []
 
     # The diagonal.
-    data.append([[-100, -100], [100, 100]])
+    data.append([[-100, -100, 0], [100, 100, 0]])
 
     # Loop over the PCS data.
     for align_id in cdp.pcs_ids:
@@ -176,7 +176,7 @@
                 continue
 
             # Append the data.
-            data[-1].append([spin.pcs[align_id], spin.pcs_bc[align_id], 
spin_id])
+            data[-1].append([spin.pcs[align_id], spin.pcs_bc[align_id], 
spin.pcs_err[align_id], spin_id])
 
     # The data size.
     size = len(data)
@@ -190,7 +190,7 @@
         grace.write_xy_header(file=file, title="PCS correlation plot", 
sets=size, set_names=[None]+cdp.pcs_ids, linestyle=[2]+[0]*size, 
data_type=['pcs', 'pcs_bc'], axis_min=[-0.5, -0.5], axis_max=[0.5, 0.5], 
legend_pos=[1, 0.5])
 
         # The main data.
-        grace.write_xy_data(data=data, file=file, graph_type='xy')
+        grace.write_xy_data(data=data, file=file, graph_type='xydy')
 
 
 def display(align_id=None):

Modified: 1.3/generic_fns/rdc.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/generic_fns/rdc.py?rev=11244&r1=11243&r2=11244&view=diff
==============================================================================
--- 1.3/generic_fns/rdc.py (original)
+++ 1.3/generic_fns/rdc.py Tue Jun 15 16:56:43 2010
@@ -114,7 +114,7 @@
     data = []
 
     # The diagonal.
-    data.append([[-100, -100], [100, 100]])
+    data.append([[-100, -100, 0], [100, 100, 0]])
 
     # Loop over the RDC data.
     for align_id in cdp.rdc_ids:
@@ -132,7 +132,7 @@
                 continue
 
             # Append the data.
-            data[-1].append([spin.rdc[align_id], spin.rdc_bc[align_id], 
spin_id])
+            data[-1].append([spin.rdc[align_id], spin.rdc_bc[align_id], 
spin.rdc_err[align_id], spin_id])
 
     # The data size.
     size = len(data)
@@ -146,7 +146,7 @@
         grace.write_xy_header(file=file, title="RDC correlation plot", 
sets=size, set_names=[None]+cdp.rdc_ids, linestyle=[2]+[0]*size, 
data_type=['rdc', 'rdc_bc'], axis_min=[-10, -10], axis_max=[10, 10], 
legend_pos=[1, 0.5])
 
         # The main data.
-        grace.write_xy_data(data=data, file=file, graph_type='xy')
+        grace.write_xy_data(data=data, file=file, graph_type='xydy')
 
 
 def display(align_id=None):




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