research
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04/19/2023
Tunable and Portable Extreme-Scale Drug Discovery Platform at Exascale: the LIGATE Approach
Today digital revolution is having a dramatic impact on the pharmaceutic...
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09/12/2022
GPU-optimized Approaches to Molecular Docking-based Virtual Screening in Drug Discovery: A Comparative Analysis
COVID-19 has shown the importance of having a fast response against pand...
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01/18/2019
Tunable Approximations to Control Time-to-Solution in an HPC Molecular Docking Mini-App
The drug discovery process involves several tasks to be performed in viv...
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01/18/2019
