[gmx-users] Integrator problem

[Lovika Moudgil]

Oo.....thanks for guiding Mark !!!

Regards
Lovika
On 8 Sep 2014 19:45, "Mark Abraham" <mark.j.abraham at gmail.com> wrote:

> The md integrator does MD, not EM...
>
> Mark
> On Sep 8, 2014 4:11 PM, "Lovika Moudgil" <lovikamoudgil at gmail.com> wrote:
>
> > Hi everyone....I want to ask one question...In my .mdp file if I use md
> > intergrator for energy minimisation .....then system is fine...but if I
> use
> > steep integrator...my system got error of more force on one atom....I
> not
> > clear why this is happeing....can any body guide me please..
> >
> > Regards
> > Lovika
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