Fast atomic charge calculation for implementation into a polarizable force field and application to an ion channel proteinWitter, Raiker; Möllhoff, Margit; Koch, Frank-Thomas; Sternberg, UlrichJournal of chemistry2015 / p. 1-14 : ill http://dx.doi.org/10.1155/2015/908204 1H line width dependence on MAS speed in solid state NMR - comparison of experiment and simulationSternberg, Ulrich; Witter, Raiker; Kuprov, Ilya; Lamley, Jonathan M.; Oss, Andres; Lewandowski, Jozef R.; Samoson, AgoJournal of magnetic resonance2018 / p. 32-39 : ill https://doi.org/10.1016/j.jmr.2018.04.003 Journal metrics at Scopus Article at Scopus Journal metrics at WOS Article at WOS Molecular dynamics simulations on PGLa using NMR orientational constraintsSternberg, Ulrich; Witter, RaikerJournal of biomolecular NMR2015 / p. 265-274 : ill http://dx.doi.org/10.1007/s10858-015-9983-y Simulation of oriented NMR spectra : combining molecular dynamics and chemical shift tensor calculationsSternberg, Ulrich; Witter, RaikerMagnetic resonance in chemistry2023 https://doi.org/10.1002/mrc.5403