Hi,
This calculation is currently not implemented in cpptraj. You may want
to look into tools that implement the mining minima method of Gilson
et. al.
-Dan
On Thu, Feb 14, 2019 at 8:48 PM Lod King <lodking407.gmail.com> wrote:
>
> Hi Amber users
>
> Does anyone know how to calculate configurational entropy by using dihedral
> angles (psi or phi), can someone show me the commands using cpptraj? or any
> analysis tools would help.
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Received on Fri Feb 15 2019 - 11:00:03 PST
