[gmx-users] dihedral distributions

Mark Abraham Mark.Abraham at anu.edu.au
Thu Mar 1 08:21:48 CET 2012

On 1/03/2012 5:07 PM, Juliette N. wrote:
> Hi all,
> Can anyone guide me how one can obtain dihedral distributions of a 
> polymer chain and how this can be used to ensure the equilibration of 
> system?
> g_angle takes a list of dihedrals and provides the dihedral 
> distribution of a given dihedral in the time interval -b to -e ?

Have a read of g_angle -h and try things out. You'll need to look in the 
literature for info on the kind of information you're looking for.


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