[gmx-users] Integrator problem

[Mark Abraham]

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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