Re: PME or not PME? What happens if PME is turned off?

From: Bjoern Olausson (namdlist_at_googlemail.com)
Date: Tue Jul 19 2011 - 01:48:50 CDT

Thanks Jerome.

Cheers,
Bjoern

On Mon, Jul 18, 2011 at 22:27, Jérôme Hénin <jhenin_at_ifr88.cnrs-mrs.fr> wrote:
> Hi Bjoern,
>
> If you turn PME off, you are running cutoff electrostatics. Yes, it's
> faster. And fullElectFrequency becomes irrelevant : there is no full
> electrostatics.
>
> Cheers,
> Jerome
>
> On 18 July 2011 11:10, Bjoern Olausson <namdlist_at_googlemail.com> wrote:
>> Hi,
>>
>> I just happened to run a simulation with PME turned off.
>

This archive was generated by hypermail 2.1.6 : Mon Dec 31 2012 - 23:20:35 CST