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Showing 1 to 2 of 2 for “"SuiteSparse"”.
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Accelerated sampling of energy landscapes
… a code for free energy basin-hopping and the SuiteSparse package for sparse Cholesky factorisation was refined, validated and tested. Tests were performed for both Lennard-Jones clusters and selected biomolecules represented using the AMBER potential. Significant acceleration of the …
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Declarative Analytics on Heterogeneous HPC Systems
… Large Network Dataset Collection and the SuiteSparse Matrix Collection. Our research extends beyond traditional graph mining and program analysis, exploring Datalog's potential in emerging domains such as topological data analysis, machine learning, and visual analytics for …