[gmx-users] I NEED HELP USING G_CLUSTER

Tivadar Orban t.orban at csuohio.edu
Tue Mar 25 22:32:01 CET 2003


Hi Joe
I have in my office the Molecular Modelling book.
You can find an answer for that there.
tivi
On 3/25/03 7:42 AM, "Joseph Pichler" <j.a.pichler at csuohio.edu> wrote:

>   Dear Gromacs users,
> I am going to be running a MD simulation on a large system (NOS roughly
> 13,000 atoms and wish to cluster the simulation trajectory.  I wish to
> cluster the system into similar conformations.  I don't understand how the
> g_cluster command works.  If anyone has any information pertaining to the
> g_cluster command, please educate me.
>           
> 
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