NAMD on TeraGrid: OpenMP?
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I am starting to run simulations on the TeraGrid. Can anyone suggest if we should use only one
instance of the simulation on each multi processor node or the number of instances be equal to the
number of processors? Basically, the question boils down to: has OpenMP been used in NAMD or is
NAMD solely MPI?
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: Wed Feb 29 2012 - 15:42:21 CST