[gmx-users] RDF

Saikat Pal saikatpaliitg at yahoo.com
Wed Jul 12 17:48:34 CEST 2017


Dear Vidya.R
Its very difficult to answer this question.It depends on your system .If you run more time of your system, RDF will be more smooth

Saikat Pal
IIT GUWAHATI



On Wednesday 12 July 2017, 10:02:30 AM IST, Vidya R <vidyadevi2811 at gmail.com> wrote:

Hi,

I want to calculate RDF of my organic molecule with a solvent.

What should be the duration of my simulation?

Is 100 ps enough?


Thanks,
Vidya.R
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