[gmx-users] Re: multiple time step

[Vitaly Chaban]

Chris,

An interesting question...

BTW, is there any philosophy of gromacs developers to avoid this
algorithm in the MD engine?

Vitaly



> multiple timesteps are not possible as far as gromacs 4.0.7. NAMD can do this.
>
>
> -- original message --
>
> Is it possible to carry out  multiple time step  molecular
> dynamics simulations
> in Gromacs
> 4.0. versions ? Could you
> please give me some information about this issue ?
>
> Thank you very much for your attention.