[gmx-users] dihedral distributions
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
> 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.
More information about the gromacs.org_gmx-users