[AMBER] output pairwise energies

From: Dian Jiao <oscarjiao.gmail.com>
Date: Wed, 13 Oct 2010 11:25:04 -0600

Hi all,

Is there way to output pairwise interaction energies between atoms in the
simulation mdout file? I got huge bond energy and that killed the run. Just
wanted to pinpoint which bond(s) is causing that. Thanks.

~ DJ
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Received on Wed Oct 13 2010 - 10:30:07 PDT