On Fri, Sep 25, 2020, Maschietto, Federica wrote:
>
>I would like to run a MD simulation constraining backbone dihedrals such
>that my complex is able to relax but does not deviate too much from the
>original structure.
Dihedral restraints are called "NMR" restraints in Amber. See Section
27.1 ("Distance, angle and torsional restraints") in the Reference Manual.
....dac
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Received on Sat Sep 26 2020 - 05:30:02 PDT
