Membrane Insertion of a Dinuclear Polypyridylruthenium(II) Complex Revealed by Solid-State NMR and Molecular Dynamics Simulation: Implications for Selective Antibacterial ActivityDaniel K. WeberMarc-Antoine Saniet al.2016JACS
Dynamic Modelling Reveals ‘Hotspots’ on the Pathway to Enzyme-Substrate Complex FormationShane E. GordonDaniel K. Weberet al.2016PLoS Computational Biology
Characterization of the lipid-binding site of equinatoxin II by NMR and molecular dynamics simulationDaniel K. WeberShenggen Yaoet al.2015Biophysical Journal