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Efficient parameter tuning for a structure-based virtual screening HPC application
B. Guindani
,
D. Gadioli
,
R. Rocco
,
D. Ardagna
,
G. Palermo
January 2025
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DOI
URL
Type
Journal article
Publication
JOURNAL OF PARALLEL AND DISTRIBUTED COMPUTING
Application Autotuning; Bayesian Optimization; High-Performance Computing; Virtual Screening
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