[gmx-users] how to restrain secondary structure?

Albert mailmd2011 at gmail.com
Sat Nov 25 21:15:32 CET 2017

thank you for the reply.

May I ask which command should I use?

I checked,

gmx_mpi genrestr

but I cannot find the option you mentioned.

thanks a lot.

On 11/25/2017 09:02 PM, Justin Lemkul wrote:
> Apply [dihedral_restraints] to the phi and psi torsions you want to 
> restrain.
> -Justin
> -- 

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