[AMBER] Fix the dihedral angle during the simulation

From: Rinsha Chk <rinshachk.gmail.com>
Date: Sun, 7 Feb 2021 14:36:16 +0530

Dear all,
I am performing MD simulation on two isomers of azobenzene (no NMR
study), but during the simulation at 300K (upper limit temperature), the
cis-azobenzene become trans. Is there any way to fix the dihedral angle
during the simulation?

Thanks and Regards,
Rinsha C H
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Received on Sun Feb 07 2021 - 01:30:02 PST