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Supplementary Information for Heterogeneous Parallelization and Acceleration of Molecular Dynamics Simulations in GROMACS

Szilárd Páll


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    <subfield code="a">&lt;p&gt;Supplementary information for&lt;br&gt;
P&amp;aacute;ll, S., Zhmurov, A., Bauer, P., Abraham, M., Lundborg, M., Gray, A., Hess, B, &amp;amp; Lindahl, E.. (2020). Heterogeneous Parallelization and Acceleration of Molecular Dynamics Simulations in GROMACS. The Journal of Chemical Physics, 2020&lt;/p&gt;

&lt;p&gt;Contains benchmark methodology description as well as all inputs used in the application performance benchmarks included the paper.&lt;/p&gt;</subfield>
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