[gmx-users] rdf calculation for wormlike micelles
e.jjordan12 at gmail.com
Wed Mar 14 10:12:46 CET 2018
See here for info on the selection syntax
On Wed, Mar 14, 2018 at 10:01 AM, Esra Kaçar <esrakacar at iyte.edu.tr> wrote:
> Dear all,
> I am working on a wormlike micelle that has a curved structure. I want to
> calculate the radial distribution functions of constituent molecules with
> respect to the backbone (the line following the micelle length and
> represents the center of the curved cylindrical structure) of the wormlike
> micelle. Since the structure is curved, I couldn’t find out how to select
> the backbone as a reference point in g_rdf. I am using Gromacs v 5.1. Any
> suggestions would be appreciated.
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