[gmx-users] Help for GNUPlot

2008-05-06 Thread s lal badshah
Dear Mark, Hi ! Currently I tried to install xmgrace but the toolbar menue is not shown on window screen so I am using gnuplot for analysis as I have little know how about unix/linux.Please set to me the following. [EMAIL PROTECTED]:~ cd project [EMAIL PROTECTED]:~/project ls #bfac.pdb.1#

Re: [gmx-users] Help for GNUPlot

2008-05-06 Thread Florian Haberl
Hi, On Tuesday, 6. May 2008 15:07, s lal badshah wrote: Dear Mark, Hi ! Currently I tried to install xmgrace but the toolbar menue is not shown on window screen so I am using gnuplot for analysis as I have little know how about unix/linux.Please set to me the following. [EMAIL PROTECTED]:~

Re: [gmx-users] Help for GNUPlot

2008-05-06 Thread Per Larsson
Hello! Please note that xmgrace and gunplot are two different programs and as such work in different ways, for example in terms of what types of input and output they expect. The xvg-files that Gromacs produces are indended for xmgrace, and will not work out-of-the-box with gnuplot.

Re: [gmx-users] Help for GNUPlot

2008-05-06 Thread Mark Abraham
Florian Haberl wrote: take a look on your data file less rmsf.xvg first 12 lines or so are without data. It is the header for xmgrace, so you have to ignore them your delete out of the file. You can also analyse the data with the flag -noxvgr, than it will be written without xmgrace

Re: [gmx-users] Help for GNUPlot

2008-05-06 Thread Zoltan Varga
Hi, Actually gnuplot can plot the xvg files without any modification. It skips all the lines in the file which is not compatible with the command: u 1:2 The problem is the missing word about how to draw the data. Maybe you have also recognized it meanwhile. In the correct form: plot rmsf.xvg u

Re: [gmx-users] Help for GNUPlot

2008-05-06 Thread Mark Abraham
Zoltan Varga wrote: Hi, Actually gnuplot can plot the xvg files without any modification. It skips all the lines in the file which is not compatible with the command: u 1:2 Interesting, that's true. I'll update the wiki. If one is happy using the using approach then that works, but for