65 citations · 65 across the 2 of their papers we have counts for
2 papers
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…
q-bio.BM2016
On the Asymmetry of Vibrational Energy Flow
German Miño-Galaz, Junia Melin, Gonzalo Gutierrez +3
A simple model to predict the directionality of vibrational energy flow at molecular level is presented. This model is based on a vibrational energy propagation analysis using ab i…