Revision: 150
Author: atenderholt
Date: 2006-05-22 17:16:35 -0700 (Mon, 22 May 2006)
ViewCVS: http://svn.sourceforge.net/cclib/?rev=150&view=rev
Log Message:
-----------
Changed the info for the logger.
Decided that it's not too slow. When I said it was slow, I was looking at generating overlap populations for 40 different fragments, which is a bit extreme as it's usually done between 5-10 fragments. There ought to be a Numeric trick to speed it up, but I haven't had any luck so I'm giving up for now.
Modified Paths:
--------------
trunk/src/cclib/method/opa.py
Modified: trunk/src/cclib/method/opa.py
===================================================================
--- trunk/src/cclib/method/opa.py 2006-05-22 23:32:17 UTC (rev 149)
+++ trunk/src/cclib/method/opa.py 2006-05-23 00:16:35 UTC (rev 150)
@@ -82,7 +82,7 @@
#determine number of steps, and whether process involves beta orbitals
nstep=nmocoeffs
nfrag=len(indices) #nfrag
- self.logger.info("Creating attribute aoresults: array[3]")
+ self.logger.info("Creating attribute results: array[4]")
if unrestricted:
self.results=Numeric.ones([2,nmocoeffs,nfrag,nfrag],"f")
nstep+=nmocoeffs
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