Showing items from Best Practices

Running GROMACS on GPU instances

Comparing the performance of real applications across different Amazon Elastic Compute Cloud (Amazon EC2) instance types is the best way we’ve found for finding optimal configurations for HPC applications here at AWS. Previously, we wrote …

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Bare metal performance with the AWS Nitro System

High Performance Computing (HPC) is known as a domain where applications are well-optimized to get the highest performance possible on a platform. Unsurprisingly, a common question when moving a workload to AWS is what performance …

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Numerical weather prediction on AWS Graviton2

The Weather Research and Forecasting (WRF) model is a numerical weather prediction (NWP) system designed to serve both atmospheric research and operational forecasting needs. With the release of Arm-based AWS Graviton2 Amazon Elastic …

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GROMACS price-performance optimizations on AWS

Molecular dynamics (MD) is a simulation method for analyzing the movement and tracing trajectories of atoms and molecules where the dynamics of a system evolve over time. MD simulations are used across various domains such as material …

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