Performance metrics in a hybrid MPI-OpenMP based molecular dynamics simulation with short-range interactions
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JOURNAL OF PARALLEL AND DISTRIBUTED COMPUTING
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Pal, A., Agarwala, A., Raha, S., & Bhattacharya, B.
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Pal, Anirban||Agarwala, Abhishek||Raha, Spumyendu||Bhattacharya, Baidurya
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Hybrid Programming
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Message Passing
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Molecular Dynamics
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Openmp Threading
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Parallel Computing
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http://dx.doi.org/10.1016/j.jpdc.2013.12.008