5 citations · 5 across the 1 of their papers we have counts for
2 papers
physics.atm-clus2018
Relative energetics of acetyl-histidine protomers with and without Zn2+ and a benchmark of energy methods
Markus Schneider, Carsten Baldauf
We studied acetylhistidine (AcH), bare or microsolvated with a zinc cation by simulations in isolation. First, a global search for minima of the potential energy surface combining…
physics.atm-clus2017★ 5 cited
Kinetically Trapped Liquid-State Conformers of a Sodiated Model Peptide Observed in the Gas Phase
Markus Schneider, Chiara Masellis, Thomas Rizzo +1
We investigate the peptide AcPheAla5LysH+, a model system for studying helix formation in the gas phase, in order to fully understand the forces that stabilize the helical structur…