431 citations · 934 across the 11 of their papers we have counts for
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q-bio.BM2024★ 65 cited
The need to implement FAIR principles in biomolecular simulations
Rommie Amaro, Johan Åqvist, Ivet Bahar +125
This letter illustrates the opinion of the molecular dynamics (MD) community on the need to adopt a new FAIR paradigm for the use of molecular simulations. It highlights the necess…
physics.comp-ph2024★ 3 cited
Bayesian electron density determination from sparse and noisy single-molecule X-ray scattering images
Steffen Schultze, Helmut Grubmüller
Single molecule X-ray scattering experiments using free electron lasers hold the potential to resolve both single structures and structural ensembles of biomolecules. However, mole…