02c3ca4376
software developed at Daresbury Laboratory by I.T. Todorov and W. Smith. WWW: http://ccpforge.cse.rl.ac.uk/gf/project/dl_poly_classic/ PR: ports/166725 Submitted by: Jason Bacon <jwbacon@tds.net>
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548 B
Text
12 lines
548 B
Text
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This port provides both serial and parallel (MPI) binaries. Use of
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the MPI binary is strongly recommended on any machine with multiple
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cores available. The serial binary is provided only for testing and
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very small models.
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To run a model on a workstation using 4 cores, use:
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mpirun -n 4 dlpoly-classic-mpi
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To run on a cluster, please see the documentation for your scheduler software.
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