COLVAR printing

[ilya]

Thanks.

Strange place for colvar printing. If not doing metadynamics it's very
difficult to find.
(I tried to find it in __ROOT__%FORCE_EVAL%SUBSYS%COLVAR%PRINT).

Ilya.

On May 6, 7:21 pm, Teodoro Laino <teodor... at gmail.com> wrote:
> That's it:http://cp2k.berlios.de/input/
> InputReference~__ROOT__~MOTION~FREE_ENERGY~METADYN~PRINT~COLVAR.html
>
> Teo
> On 6 May 2008, at 17:19, ilya wrote:
>
>
>
> > Hello!
>
> > I'm sorry for disturbing you again but after a lot of reading &
> > experimenting I didn't find an answer.
> > Is there a way to print a colvar at each MD step to a file? Or maybe I
> > should calculate it's value from geometry after the simulation?
>
> > Thanks again.
> > Ilya.