[gmx-users] g_cluster

Albert mailmd2011 at gmail.com
Wed Jan 29 11:23:00 CET 2014


I am using g_cluster to cluster a peptide conformation from Gromacs. It 
generate a black/white .xpm file and a .log file.

However, it doesn't generate an average structure for each cluster. So, 
I am just wondering, how can we also export one avarage structure for 
each cluster?

thank you very much.

best wishes

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