mahmoud mirzaei wrote:
Hello Dear GMX Users,
I have installed Gromacs 4 on a Quad PC.
However, when I RUN the example (Water), the CPU usage is just 25%. It
means that just one of the four CPUs are used.
Please help me how I can change the status of calculation for using all
of the four CPUs.
You need to install an MPI implementation, and configure Gromacs with
--enable-mpi.
-Justin
Thank you very much in advance.
Mahmoud<
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--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
========================================
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