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Massively parallel molecular dynamics simulations of lysozyme unfolding.

, , , , , and . IBM Journal of Research and Development, 52 (1-2): 19-30 (2008)

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Early performance data on the Blue Matter molecular simulation framework., , , , , , and . IBM Journal of Research and Development, 49 (2-3): 447-456 (2005)Performance Measurements of the 3D FFT on the Blue Gene/L Supercomputer., , , , and . Euro-Par, volume 3648 of Lecture Notes in Computer Science, page 795-803. Springer, (2005)Progress in Scaling Biomolecular Simulations to Petaflop Scale Platforms., , , , , , and . Euro-Par Workshops, volume 4375 of Lecture Notes in Computer Science, page 279-288. Springer, (2006)Blue Gene: A vision for protein science using a petaflop supercomputer., , , , , , , , , and 42 other author(s). IBM Systems Journal, 40 (2): 310-327 (2001)Demonstrating the scalability of a molecular dynamics application on a Petaflop computer., , , , , , , , , and 3 other author(s). ICS, page 393-406. ACM, (2001)A Volumetric FFT for BlueGene/L., , , and . HiPC, volume 2913 of Lecture Notes in Computer Science, page 194-203. Springer, (2003)Blue matter on blue gene/L: massively parallel computation for biomolecular simulation., , , , , , , and . CODES+ISSS, page 207-212. ACM, (2005)Blue Matter: Strong Scaling of Molecular Dynamics on Blue Gene/L., , , , , , , , , and 4 other author(s). International Conference on Computational Science (2), volume 3992 of Lecture Notes in Computer Science, page 846-854. Springer, (2006)Scalable framework for 3D FFTs on the Blue Gene/L supercomputer: Implementation and early performance measurements., , , , and . IBM Journal of Research and Development, 49 (2-3): 457-464 (2005)Blue Matter: Scaling of N-body simulations to one atom per node., , , , , , , , and . IBM Journal of Research and Development, 52 (1-2): 145-158 (2008)