Published April 15, 2026
| Version v1
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How big Data Processing helps with Molecular Dynamics Data Processing - EXAKI training
Authors/Creators
Description
Molecular dynamics simulations produce enormous volumes of valuable data, but turning them into useful insight is challenging. In this training, David Číž (IT4Innovations) presents how the EXA4MIND extreme data platform automates simulation data processing using extracting key metadata and preparing results for efficient analysis. The end-to-end workflow demonstrates how modern data orchestration accelerates research in computational chemistry and materials science.
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Airflow Valeo Presentation.pdf
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(1.9 MB)
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Additional details
Dates
- Accepted
-
2026-02-18