Author: bugman
Date: Mon Nov 17 18:20:05 2014
New Revision: 26608
URL: http://svn.gna.org/viewcvs/relax?rev=26608&view=rev
Log:
Improved the printouts from the align_tensor.svd user function by including the
basis set text.
Modified:
trunk/pipe_control/align_tensor.py
Modified: trunk/pipe_control/align_tensor.py
URL:
http://svn.gna.org/viewcvs/relax/trunk/pipe_control/align_tensor.py?rev=26608&r1=26607&r2=26608&view=diff
==============================================================================
--- trunk/pipe_control/align_tensor.py (original)
+++ trunk/pipe_control/align_tensor.py Mon Nov 17 18:20:05 2014
@@ -1681,8 +1681,13 @@
cdp.align_tensors.cond_num = s[0] / s[-1]
# Print out.
- print("\nData pipe: " + repr(pipes.cdp_name()))
- print("\nSingular values:")
+ sys.stdout.write("Basis set ")
+ if basis_set == 0:
+ sys.stdout.write("{Sxx, Syy, Sxy, Sxz, Syz}.\n")
+ elif basis_set == 1:
+ sys.stdout.write("{Szz, Sxx-yy, Sxy, Sxz, Syz}.\n")
+ sys.stdout.write("Data pipe: %s\n" % pipes.cdp_name())
+ sys.stdout.write("\nSingular values:\n")
for val in s:
- print(" %.4e" % val)
- print("\nCondition number: %.2f" % cdp.align_tensors.cond_num)
+ sys.stdout.write(" %.4e\n" % val)
+ sys.stdout.write("\nCondition number: %.2f\n" % cdp.align_tensors.cond_num)
_______________________________________________
relax (http://www.nmr-relax.com)
This is the relax-commits mailing list
[email protected]
To unsubscribe from this list, get a password
reminder, or change your subscription options,
visit the list information page at
https://mail.gna.org/listinfo/relax-commits
