I mean,
Is it possible to directly build a matrix of the H-bond occupancy of
each residue for the others?
Thank you
giulia
---------- Forwarded message ----------
From: giulia palermo <giulia.palermo83.gmail.com>
Date: 2017-03-02 9:26 GMT-08:00
Subject: H-bonds matrix
To: AMBER Mailing List <amber.ambermd.org>
Dear all,
is there a way to use cpptraj to build an H-bond matrix, such that for
each residue, we can track the H-bonding with each other?
Thank you very much
Giulia
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Thu Mar 02 2017 - 12:00:02 PST
