cp2k/gromacs QM/MM calculation in cp2k?

[Alex]

Hi Abhi,

What exactly do you mean by this? Gromacs is a separate simulator with its 
own forcefields and setup. Do you mean using a Gromacs forcefield within 
CP2K?

Alex

On Thursday, December 11, 2014 6:32:59 AM UTC-7, Abhi wrote:
>
> Dear cp2k users, 
> Is it possible to perform a cp2k/gromacs QM/MM calculation in cp2k? 
>
> thank you in advance. 
>
> with regards,
> Abhi
>
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