[gmx-users] Replica Exchange / nodes

Arturas Ziemys ziemys at chbmeng.ohio-state.edu
Wed Aug 29 18:41:24 CEST 2007


How to access CVS of GROMACS ?

Robert Johnson wrote:
> The CVS version of Gromacs enables REMD simulations where each replica
> can be run across multiple CPUs.
> Bob
> 
> On 8/29/07, Arturas Ziemys <ziemys at chbmeng.ohio-state.edu> wrote:
>> Hi,
>>
>> After I was reading manual on REMD and mdrun, I understood that GROMACX
>> is capable to run REMD using just one node per replica (or single CPU
>> ??). Is it right ?
>>
>> Best
>> Arturas
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