[gmx-users] restricted clustering

Mark Abraham Mark.Abraham at anu.edu.au
Wed Dec 13 04:35:36 CET 2006

Giacomo Bastianelli wrote:
> Dear Users,
> I would like to cluster my MD trajectory based
> only on few residues and not on the all protein.
> Is there a way to do that?

g_cluster -n

will probably prompt you to choose a group for the clustering.


More information about the gromacs.org_gmx-users mailing list