[gmx-users] override dispalying of options

Mark Abraham Mark.Abraham at anu.edu.au
Wed Oct 29 12:52:28 CET 2008


Inon Sharony wrote:
> Hello GROMACS users & team
> 
> I would like to run grompp and mdrun from the command line without 
> having to see all the possible flags and options. I'm running a few 
> commands in series, so I can't use "grompp &" and then "mdrun &"
> Is there some way to call these functions without having to display all 
> of the (unnecessary) details?

No. You shouldn't want such a facility. Making multiple commands into a 
script and saving all of the output into a file is the easiest way of 
being able to find out exactly what you did after your short-term memory 
fades. less and grep are probably your friends once you've got that 
output file.

(Or you could make like a real scientist and copy your command lines 
down longhand into your laboratory notebook.... <puke>)

Mark



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