[gmx-users] g_RMS

[David]

On Tue, 2005-10-25 at 17:33 +0200, Michal Kolinski wrote:
> Its excel format.
Sorry we don't support Microsoft.

> Here's  the orginal file:

No this is another file...

It's probably something with fitting on the protein and checking the
rmsd of the ligand which is somewhere else through PBC.
> 
> # This file was created by g_rmsf_mpi
> # which is part of G R O M A C S:
> # Grunge ROck MAChoS
> # All this happened at: Tue Oct 25 13:37:07 2005
> #
> @    title "RMS fluctuation"
> @    xaxis  label "Atom"
> @    yaxis  label "(nm)"
> @TYPE xy
>     1   2.9867
>     2   2.9905
>     3   2.9866
>     4   3.0304
>     5   3.0281
>     6   3.0264
>     7   2.7774
>     8   2.7673
>     9   2.7798
>    10   3.8776
>    11   3.8823
>    12   3.8796
>    13   3.0144
>    14   3.0176
>    15   3.0193
>    16   3.4566
>    17   3.4547
>    18   3.4595
>    19   3.6069
>    20   3.6135
>    21   3.6056
>    22   4.1903
> 
> 
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,          75124 Uppsala, Sweden
phone:  46 18 471 4205          fax: 46 18 511 755
spoel at xray.bmc.uu.se    spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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