Tunable approximations to control time-to-solution in an HPC molecular docking Mini-App

Davide Gadioli, Gianluca Palermo, Stefano Cherubin, Emanuele Vitali, Giovanni Agosta, Candida Manelfi, Andrea R. Beccari, Carlo Cavazzoni, Nico Sanna, Cristina Silvano. Tunable approximations to control time-to-solution in an HPC molecular docking Mini-App. The Journal of Supercomputing, 77(1):841-869, 2021. [doi]

Authors

Davide Gadioli

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Gianluca Palermo

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Stefano Cherubin

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Emanuele Vitali

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Giovanni Agosta

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Candida Manelfi

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Andrea R. Beccari

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Carlo Cavazzoni

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Nico Sanna

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Cristina Silvano

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