Runtime steering of molecular dynamics simulations through in situ analysis and annotation of collective variables
This paper targets one of the most common simulations on petascale and, very likely, on
exascale machines: molecular dynamics (MD) simulations studying the (classical) time …
exascale machines: molecular dynamics (MD) simulations studying the (classical) time …
Co-scheduling ensembles of in situ workflows
Molecular dynamics (MD) simulations are widely used to study large-scale molecular
systems. HPC systems are ideal platforms to run these studies, however, reaching the …
systems. HPC systems are ideal platforms to run these studies, however, reaching the …
An Intelligent Framework for Efficiently Utilizing Distributed Heterogeneous Resources to Improve HPC Application Performance
M Arif - 2024 - repository.rit.edu
Abstract High-Performance Computing (HPC) workloads are being widely used to solve
complex problems in scientific applications from diverse domains, such as weather …
complex problems in scientific applications from diverse domains, such as weather …
Reproducing and Extending Analytical Performance Models of Generalized Hierarchical Scheduling
J Luettgau, S Caino-Lores, K Suarez… - 2022 IEEE 18th …, 2022 - ieeexplore.ieee.org
Workflows in High-Performance Computing (HPC) are rapidly changing towards more
complex and large-scale workflows. In particular, high-throughput and ensemble workflows …
complex and large-scale workflows. In particular, high-throughput and ensemble workflows …
Business Process Management & Workflow
B Hayat - 2024 - dspace.univ-usto.dz
Ce polycopié de cours s' inscrit dans l'administration des systèmes informatiques et vient
compléter tous les cours autour de la numérisation digitalisation. Ce cours s' intéresse …
compléter tous les cours autour de la numérisation digitalisation. Ce cours s' intéresse …