[gmx-users] (no subject)

sarbani chattopadhyay sarbani_c84 at rediffmail.com
Fri Oct 12 13:14:29 CEST 2007


  hi,
     I am using gromacs to run MD simulations using "Intel dual core machine OSX (version 
10.4.10) ".I downloaded the 'already compiled gromacs package'. Is there any way to find 
whether the simulation process makes optimum usage of the 2 processors.
Is there any command to direct the 'mdrun' that takes the optimum advantage of the 
available processors?

We have another machine which has "Xeon Quad Core ,the MAC version being 10.4.10.
How to run gromacs making optimum usage of the 4 processors?

Is there any method to use "XGRID" built in OSX?

Any suggestions are welcome.Thanks

Sarbani
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