Zarrtraj: A Python package for streaming molecular dynamics trajectories from cloud services

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Authors

Lawson J. Woods · Arizona State University

Hugo MacDermott-Opeskin · Open Geospatial Consortium

Edis Jakupovic · Arizona State University

Yuxuan Zhuang · Stanford University

Richard Gowers · CTI BioPharma (United Kingdom)

Oliver Beckstein · Arizona State University

Abstract

Zarrtraj is an MDAnalysis MDAKit for streaming H5MD and ZarrMD trajectory files from cloud storage like AWS S3, Google Cloud Buckets, and Azure Data lakes and Blob Storage

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Publication Details

Published in: Zenodo (CERN European Organization for Nuclear Research)

DOI: 10.5281/zenodo.18819440

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Zarrtraj: A Python package for streaming molecular dynamics trajectories from cloud services

Authors

Abstract

Topics & Keywords

Publication Details