[gmx-users] atoms over 100,000

[Albert]

thx a lot for the reply.

But if I would like to define atom  100'001, should I just specify 
100'001 directly and Gromacs will treat it without any problem?

thanks again

Albert


On 10/09/2014 04:45 PM, Erik Marklund wrote:
> Hi,
>
> Atom indices in gro files aren't actually used by the gromacs tools. Hence going over 100,000 is not a problem.
>
> Kind regards,
> Erik
>
>
> Erik Marklund, PhD
> Postdoctoral Research Fellow, JRF
>
> Department of Chemistry
> Physical & Theoretical Chemistry Laboratory
> University of Oxford
> South Parks Road
> Oxford
> OX1 3QZ