Re: [Avogadro-Discuss] AutoOptimization

2016-10-23 Thread Patrick Avery
My best guess is that when you open a Gaussian file by double clicking it, it results in Avogadro's runtime location being in that directory (which means it won't find the force field files). For now, I'd always open Avogadro by using the shortcut, and then open the Gaussian file using the "Open"

Re: [Avogadro-Discuss] AutoOptimization

2016-10-23 Thread Andre Persoons
Dear Patrick, are these problems related to PC ? I use MAC and have never had a problem with Avogadro. Cheers, Andre On 22 Oct 2016, at 16:34, Patrick Avery > wrote: Hi Michael, This usually means the force field files were not found. These

Re: [Avogadro-Discuss] AutoOptimization

2016-10-23 Thread Željko M . Svedružić
Michael, most of the molecular modeling software does not tolerate "Program Files" in the path name. The code for all those programs is written for Linux and just adapted to windows. Linux does not recognize empty space, i.e. "Program Files" should be "Program_Files". Thus, when I have to