Improving computation efficiency using input and architecture features for a virtual screening application

Virtual screening is an early stage of the drug discovery process that selects the most promising candidates. In the urgent computing scenario it is critical to find a solution in a short time frame. In this paper, we focus on a real-world virtual screening application to evaluate out-of-kernel opti...

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Hauptverfasser:	Accordi, Gianmarco, Vitali, Emanuele, Gadioli, Davide, Crisci, Luigi, Cosenza, Biagio, Bisson, Mauro, Fatica, Massimiliano, Beccari, Andrea, Palermo, Gianluca
Format:	Artikel
Sprache:	eng
Schlagworte:	Computer Science - Computational Engineering, Finance, and Science Computer Science - Distributed, Parallel, and Cluster Computing Computer Science - Hardware Architecture
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