[gmx-users] parallel problem
Osmany Guirola Cruz
osmany.guirola at cigb.edu.cu
Wed Sep 3 22:54:01 CEST 2003
No i have dual PIII 933MHz coupled by tcp/ip
It is 100 Mbit
My cluster have a switch i have 32 dual in a sub-net and only one
machine is in my network (PBS)
I do a simulation whit 9500 molecules of water (SOL) 129 proteins residue
No i dont do the gromacs benchmarks , HOW COULD I DO IT?
i forget something , my simulations whith cutoff are shorter than PME
Really i need help, i have 32 machines and only use one for my
simulations :-(
David wrote:
>On Wed, 2003-09-03 at 22:16, Osmany Guirola Cruz wrote:
>
>
>>This is not the first time that i make the same question, how should i do gromacs work well whith lam in my linux cluster , a simulation in one machine is shorter than two machines , my last steep was compile the lammpi source whith the option tcp-short=524288 (512kb) and nothing happens .
>>
>>PLEASE HELPMEEEEEEEEEEEEEEEEEEEEEE
>>
>>
>I'll just assume you have single processor machines coupled by tcp/ip
>network, is that correct?
>
>Is it 10 Mbit/s, 100 Mbit/s or better?
>
>Do you have a switch between the machines or a hub?
>
>How large is your system to simulate?
>
>Did you try to reproduce the gromacs benchmarks?
>
>
>
>>
>>
>>
>>
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