[gmx-users] Less than Graceful

Yang Ye leafyoung at yahoo.com
Mon Jul 9 07:06:03 CEST 2007


On 7/9/2007 12:47 PM, Mark Abraham wrote:
> Jim Kress wrote:
>
>> Unfortunately, I need Grace since it is the only graphics program 
>> supported
>> by gromacs (my primary MD code)
>
> Nah... the xvg output files are readily readable by lots of programs - 
> you just lose the labelling of axes and data sets (which isn't always 
> right anyway). In particular, there's a command for gnuplot to tell it 
> to ignore the lines starting with both "@" and "#" as comments, and 
> now you're home free...
And for almost all gromacs progs, -noxvgr can be used to output data 
only without Grace-specific code.
>
> Mark
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