VMD-L Mailing List
From: Hay, Stuart (Stuart.Hay_at_cchmc.org)
Date: Thu Apr 03 2014 - 12:35:55 CDT
I would like to optimize the geometry in my protein through the force field toolkit in VMD. However, to do so, I need a "Gaussian Log File", which I have had no luck in finding or obtaining. I understand what it is used for, but I do not know how to generate it.