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Dynamic load balancing algorithm for molecular dynamics based on Voronoi cells domain decompositions.

, , and . Comput. Phys. Commun., 183 (12): 2608-2615 (2012)

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Performance Characteristics of Hardware Transactional Memory for Molecular Dynamics Application on BlueGene/Q: Toward Efficient Multithreading Strategies for Large-Scale Scientific Applications., , , , , and . IPDPS Workshops, page 1326-1335. IEEE, (2013)Exploring Traditional and Emerging Parallel Programming Models Using a Proxy Application., , , , , , , , , and 3 other author(s). IPDPS, page 919-932. IEEE Computer Society, (2013)Beyond homogeneous decomposition: scaling long-range forces on Massively Parallel Systems., , , , , , , , , and 1 other author(s). SC, ACM, (2009)Analysis of scalable data-privatization threading algorithms for hybrid MPI/OpenMP parallelization of molecular dynamics., , , , , and . The Journal of Supercomputing, 66 (1): 406-430 (2013)The Use of Conformal Voxels for Consistent Extractions from Multiple Level-Set Fields., , and . International Conference on Computational Science (3), volume 3516 of Lecture Notes in Computer Science, page 49-56. Springer, (2005)Extending stability beyond CPU millennium: a micron-scale atomistic simulation of Kelvin-Helmholtz instability., , , , , and . SC, page 58. ACM Press, (2007)Performance Analysis Techniques for the Exascale Co-Design Process., , , , , , , , , and 3 other author(s). PARCO, volume 25 of Advances in Parallel Computing, page 19-32. IOS Press, (2013)Evaluating User-Level Fault Tolerance for MPI Applications., , , , and . EuroMPI/ASIA, page 57. ACM, (2014)Preparation and optimization of a diverse workload for a large-scale heterogeneous system., , , , , , , , , and 69 other author(s). SC, page 32:1-32:17. ACM, (2019)Enabling Work Migration in CoMD to Study Dynamic Load Imbalance Solutions., , , and . PMBS@SC, page 98-107. IEEE Computer Society, (2016)