[gmx-users] Re: multiple time step
vvchaban at gmail.com
Tue Jun 29 17:58:54 CEST 2010
An interesting question...
BTW, is there any philosophy of gromacs developers to avoid this
algorithm in the MD engine?
> 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.
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