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Dokumenttyp:
Studienarbeit
Autor(en):
Gratl, Fabio Alexander
Titel:
Implementation and Evaluation of Task-based Approaches for Molecular Dynamics Simulations
Übersetzter Titel:
Entwicklung und Evaluation Task-basierter Ansätze für Molekulardynamik Simulationen
Abstract:
ls1-mardyn is a molecular dynamics code specialized in simulations of very large scale of up to 4.125 × 10 12 particles [EHB + 13]. Although the established approach for its force calculation, which is using coloring and OpenMP loop parallelization, proves to be very efficient, it still leaves potential for optimization because of its use of barriers. A promising method to replace these barriers are task-based scheduling concepts due to their higher flexibility and finer granularity. As su...     »
Stichworte:
Molecular Dynamics; Task based
Aufgabensteller:
Bungartz, Hans-Joachim
Betreuer:
Tchipev, Nikola
Jahr:
2017
Quartal:
2. Quartal
Jahr / Monat:
2017-04
Monat:
Apr
Sprache:
en
Hochschule / Universität:
Technical University of Munich
Fakultät:
Fakultät für Informatik
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