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Photo Lynn Kamerlin

Lynn Kamerlin

Professor

Photo Lynn Kamerlin

The need to implement FAIR principles in biomolecular simulations

Author

  • R.E. Amaro
  • S.C.L. Kamerlin
  • M. Orozco

Summary, in English

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. © The Author(s), under exclusive licence to Springer Nature America, Inc. 2025.

Department/s

  • Computational Chemistry

Publishing year

2025

Language

English

Pages

641-645

Publication/Series

Nature Methods

Volume

22

Issue

4

Document type

Article

Publisher

Nature Publishing Group

Topic

  • Biochemistry

Keywords

  • big data
  • FAIR principles
  • human
  • molecular dynamics
  • nonhuman
  • note
  • simulation
  • article

Status

Published

ISBN/ISSN/Other

  • ISSN: 1548-7091