[gmx-users] distance dependent energy

Erik Marklund erik.marklund at chem.ox.ac.uk
Tue Sep 22 18:12:09 CEST 2015

Dear Van,

Plot against the COM distance, which you can get as a function of time too.

Kind regards,

Erik Marklund, PhD
Postdoctoral Research Fellow
Fulford JRF, Somerville College

Department of Chemistry
Physical & Theoretical Chemistry Laboratory
University of Oxford
South Parks Road

> On 22 Sep 2015, at 16:47, Cuong Nguyen <nvcuong68 at gmail.com> wrote:
> Dear Gromacs users,
> I would like to work out the energy (total and kinetic) as a function of
> the distance from the center of mass of a droplet. However, using g_energy
> just gave me the values as a function of time. Could anyone tell me the way
> to get the distance dependent values?
> Thank you very much in advance.
> Kind regards,
> Van
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