110 citations
- Centre National de la Recherche ScientifiqueFR2 papers
- Sorbonne UniversitéFR2 papers
- University of BristolGB2 papers
- Barcelona Supercomputing CenterES1 paper
- Biologie Computationnelle, Quantitative et SynthétiqueFR1 paper
- Biologie Moléculaire Structurale et Processus InfectieuxFR1 paper
- Budapest University of Technology and EconomicsHU1 paper
- Case Western Reserve UniversityUS1 paper
- Center for Theoretical Biological PhysicsUS1 paper
- Chicago Institute for PsychoanalysisUS1 paper
- City University of New YorkUS1 paper
- Cleveland Clinic Lerner College of MedicineUS1 paper
5 papers
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…
Modification of the law of mass action for homotypic interactions
Jerome J. Lacroix
In its general definition, the law of mass action posits that, in systems where multiple elements move randomly, the rate by which they physically interact is proportional to the p…
Inter-residue, inter-protein and inter-family coevolution: bridging the scales
Hendrik Szurmant, Martin Weigt
Interacting proteins coevolve at multiple but interconnected scales, from the residue-residue over the protein-protein up to the family-family level. The recent accumulation of eno…
The build-up of the cD halo of M87 - evidence for accretion in the last Gyr
A. Longobardi, M. Arnaboldi, O. Gerhard +1
We present kinematic and photometric evidence for an accretion event in the halo of the cD galaxy M87 in the last Gyr. Using velocities for ~300 planetary nebulas (PNs) in the M87…
Why sauropods had long necks; and why giraffes have short necks
Michael P. Taylor, Mathew J. Wedel
The necks of the sauropod dinosaurs reached 15 m in length: six times longer than that of the world record giraffe and five times longer than those of all other terrestrial animals…