The need to implement FAIR principles in biomolecular simulations

TitleThe need to implement FAIR principles in biomolecular simulations
Publication TypeJournal Article
Year of Publication2025
AuthorsAmaro, Rommie E., Åqvist Johan, Bahar Ivet, Battistini Federica, Bellaiche Adam, Beltrán Daniel, Biggin Philip C., Bonomi Massimiliano, Bowman Gregory R., Bryce Richard A., et al.
JournalNature Methods
Volume22
Issue4
Pagination641 - 645
Date Published04/2025
ISBN Number1548-7105
Abstract

In the Big Data era, a change of paradigm in the use of molecular dynamics is required. Trajectories should be stored under FAIR (findable, accessible, interoperable and reusable) requirements to favor its reuse by the community under an open science paradigm.

URLhttps://doi.org/10.1038/s41592-025-02635-0
Short TitleNature Methods
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