[CHM Research] TINKER Ready

[Andrew Pounds]

Ann and Shannon -- this morning I built and configured the Tinker 
program at set up your local environments so that you can use it while 
in Molden.

Try this:

1. open one of the molecules that you built and then get into the 
Z-Matix editor.  You should see a button to "optimize" the molecule.
2. Click this button and then select Tinker.  Another dialog box should 
open.  Select either optimize or minimize and try and run the job.

You should see your molecule "move" slightly  to optimized coordinates.  
As always, let me know what happens.


-- 
Andrew J. Pounds, Ph.D.  (pounds at theochem.mercer.edu)
Professor of Chemistry and Computer Science
Mercer University,  Macon, GA 31207   (478) 301-5627