> On 13 Oct 2016, at 15:42, gozde ergin <gozdeeer...@gmail.com> wrote:
> Dear all,
> I will use Gromacs to calculate the chemical potential difference of
> solvation a surfactant molecule on the surface.
> System covers water molecules covered with surfactant molecules.
> I will apply flat-bottom restraint to the surfactant molecules in order to
> stabilise them on surface. I will not let them to go inside the bulk.
> My question is how should I re-weight the free energy value to remove the
> effect of flat-bottom restraint potential?
> Thanks in advance.
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