Tunable and Portable Extreme-Scale Drug Discovery Platform at Exascale: the LIGATE Approach

Gianluca Palermo, Gianmarco Accordi, Davide Gadioli, Emanuele Vitali, Cristina Silvano, Bruno Guindani, Danilo Ardagna, Andrea Rosario Beccari, Domenico Bonanni, Carmine Talarico, Filippo Lunghini, Jan Martinovic, Paulo Silva 0002, Ada Bohm, Jakub Beránek, Jan Krenek, Branislav Jansik, Biagio Cosenza, Luigi Crisci, Peter Thoman, Philip Salzmann, Thomas Fahringer, Leila T. Alexander, Gerardo Tauriello, Torsten Schwede, Janani Durairaj, Andrew Emerson, Federico Ficarelli, Sebastian Wingbermühle, Eric Lindahl, Daniele Gregori, Emanuele Sana, Silvano Coletti, Philipp Gschwandtner. Tunable and Portable Extreme-Scale Drug Discovery Platform at Exascale: the LIGATE Approach. In Andrea Bartolini, Kristian F. D. Rietveld, Catherine D. Schuman, Jose Moreira, editors, Proceedings of the 20th ACM International Conference on Computing Frontiers, CF 2023, Bologna, Italy, May 9-11, 2023. pages 272-278, ACM, 2023. [doi]

Abstract

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