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020 _ _ |a 978-3-319-78053-5 (print)
020 _ _ |a 978-3-319-78054-2 (electronic)
024 7 _ |a 10.1007/978-3-319-78054-2_23
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024 7 _ |a 0302-9743
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024 7 _ |a 1611-3349
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024 7 _ |a 2128/18236
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024 7 _ |a WOS:000458563900023
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037 _ _ |a FZJ-2018-02545
082 _ _ |a 004
100 1 _ |a Halver, Rene
|0 P:(DE-Juel1)132124
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111 2 _ |a 12th International Conference on Parallel Processing and Applied Mathematics
|g PPAM 2017
|c Lublin
|d 2017-09-10 - 2017-09-13
|w Poland
245 _ _ |a Benchmarking Molecular Dynamics with OpenCL on Many-Core Architectures
260 _ _ |a Cham
|c 2018
|b Springer International Publishing
295 1 0 |a Parallel Processing and Applied Mathematics / Wyrzykowski, Roman (Editor) [0000-0003-1724-1786] ; Cham : Springer International Publishing, 2018, Chapter 23 ; ISSN: 0302-9743=1611-3349 ; ISBN: 978-3-319-78053-5=978-3-319-78054-2 ; doi:10.1007/978-3-319-78054-2
300 _ _ |a 244 - 253
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490 0 _ |a Lecture Notes in Computer Science
|v 10778
520 _ _ |a Molecular Dynamics (MD) is a widely used tool for simulations of particle systems with pair-wise interactions. Since large scale MD simulations are very demanding in computation time, parallelisation is an important factor. As in the current HPC environment different heterogeneous computing architectures are emerging, a benchmark tool for a representative number of these architectures is desirable. OpenCL as a platform-overarching standard provides the capabilities for such a benchmark. This paper describes the implementation of an OpenCL MD benchmark code and discusses the results achieved on different types of computing hardware.
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700 1 _ |a Homberg, Wilhelm
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700 1 _ |a Sutmann, Godehard
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|e Corresponding author
773 _ _ |a 10.1007/978-3-319-78054-2_23
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