[gmx-users] g_cluster

ltchong at stanford.edu ltchong at stanford.edu
Mon Mar 1 01:17:01 CET 2004


I'm having trouble figuring out how to get "g_cluster" to write out the
following for each cluster:

1. average structure
2. structure with the smallest average distance to the others in the

Can someone tell me how I can do this?  I've been trying different options
with the "-cl" flag to no avail.


Lillian T. Chong, Ph.D.				     phone: (650) 723-1097
Laboratory of Vijay Pande                            fax:   (650) 724-4021
Department of Chemistry
Stanford University
Stanford, CA 94305-5080

More information about the gromacs.org_gmx-users mailing list