[gmx-users] g_cluster

[Neha Gandhi]

Hi List,

I have come across mailing list where g_cluster can possibly be used for
clustering of docked ligands. I tried g_cluster but it will change the
reference coordinates with respect to the receptor.

Is there a way to do clustering using g_cluster based on binding site?

Many thanks,
Neha

-- 
Regards,
Dr. Neha S. Gandhi,
Curtin Research Fellow,
School of Biomedical Sciences,
Curtin University,
Perth GPO U1987
Australia
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