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GPU-optimized Approaches to Molecular Docking-based Virtual Screening in
  Drug Discovery: A Comparative Analysis

GPU-optimized Approaches to Molecular Docking-based Virtual Screening in Drug Discovery: A Comparative Analysis

12 September 2022
Emanuele Vitali
F. Ficarelli
M. Bisson
Davide Gadioli
M. Fatica
A. Beccari
G. Palermo
ArXiv (abs)PDFHTML

Papers citing "GPU-optimized Approaches to Molecular Docking-based Virtual Screening in Drug Discovery: A Comparative Analysis"

3 / 3 papers shown
Title
Tunable and Portable Extreme-Scale Drug Discovery Platform at Exascale:
  the LIGATE Approach
Tunable and Portable Extreme-Scale Drug Discovery Platform at Exascale: the LIGATE Approach
G. Palermo
Gianmarco Accordi
Davide Gadioli
Emanuele Vitali
Cristina Silvano
...
Eric Lindahl
D. Gregori
Emanuele Sana
Silvano Coletti
P. Gschwandtner
ELM
53
6
0
19 Apr 2023
A Review on Parallel Virtual Screening Softwares for High Performance
  Computers
A Review on Parallel Virtual Screening Softwares for High Performance Computers
N. A. Murugan
Artur Podobas
Davide Gadioli
Emanuele Vitali
G. Palermo
Stefano Markidis
56
35
0
30 Nov 2021
Tunable Approximations to Control Time-to-Solution in an HPC Molecular
  Docking Mini-App
Tunable Approximations to Control Time-to-Solution in an HPC Molecular Docking Mini-App
Davide Gadioli
G. Palermo
Stefano Cherubin
Emanuele Vitali
G. Agosta
C. Manelfi
A. Beccari
C. Cavazzoni
N. Sanna
Cristina Silvano
36
11
0
18 Jan 2019
1