[gmx-users] Using g_energy in a noninteractive mode script

[Esther Caballero-Manrique]

Hector,
You could use bash to choose your option, i.e.,

g_energy  <<< "yourchoice"

Esther

hseara at netscape.net wrote:
> Dear Users,
> I'm constructing a script to analize my dynamics. I need to run 
> g_energy for some of these analisis. I set everything to run  without 
> interaction with the exception of the property I want as an output. 
> Any one know how to call from bash g_energy totally noninteractive 
> mode. For instace I would like box-X as an output. I'm using gromacs 
> v-3.3.1
>  
> Thantks
> Hector Martínez-Seara Monné
> University of Barcelona
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-- 
Esther Caballero-Manrique
Graduate Teaching Fellow
Chemistry Department
1253 University of Oregon
Eugene, OR 97403 (USA)
1-541-346-2485