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Rommie E. A.♦, Aqvist J.♦, Bahar I.♦, Battistini F.♦, Bellaiche A.♦, Beltran D.♦, Philip C. B.♦, Bonomi M.♦, Gregory R. B.♦, Richard A. B.♦, Bussi G.♦, Carloni P.♦, David A. C.♦, Cavalli A.♦, Chia-En A. C.♦, Thomas E. Cheatham I.♦, Margaret S. C.♦, Chipot C.♦, Lillian T. C.♦, Choudhary P.♦, G Andres C.♦, Clementi C.♦, Poma Bernaola A.M., The need to implement FAIR principles in biomolecular simulations,
Nature Methods, ISSN: 1548-7091, DOI: 10.1038/s41592-025-02635-0, pp.1-5, 2025 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. Keywords:
FAIR principles,MD,Data,Biomolecular Simulation Affiliations:
| Rommie E. A. | - | other affiliation | | Aqvist J. | - | other affiliation | | Bahar I. | - | other affiliation | | Battistini F. | - | other affiliation | | Bellaiche A. | - | other affiliation | | Beltran D. | - | other affiliation | | Philip C. B. | - | other affiliation | | Bonomi M. | - | other affiliation | | Gregory R. B. | - | other affiliation | | Richard A. B. | - | other affiliation | | Bussi G. | - | other affiliation | | Carloni P. | - | other affiliation | | David A. C. | - | other affiliation | | Cavalli A. | - | other affiliation | | Chia-En A. C. | - | other affiliation | | Thomas E. Cheatham I. | - | other affiliation | | Margaret S. C. | - | other affiliation | | Chipot C. | - | other affiliation | | Lillian T. C. | - | other affiliation | | Choudhary P. | - | other affiliation | | G Andres C. | - | other affiliation | | Clementi C. | - | other affiliation | | Poma Bernaola A.M. | - | IPPT PAN |
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