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Showing 1–3 of 3 results
Advanced filters: Author: Federica Battistini Clear advanced filters

  • 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.

    • Rommie E. Amaro
    • Johan Åqvist
    • Modesto Orozco
    Comments & Opinion
    Nature Methods
    Volume: 22, P: 641-645

  • Parmbsc1, a new force field for DNA simulations, was broadly tested on nearly 100 DNA systems and overcame simulation artifacts that affected previous force fields.

    • Ivan Ivani
    • Pablo D Dans
    • Modesto Orozco
    Research
    Nature Methods
    Volume: 13, P: 55-58