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The Journal of Chemical Physics|October 5, 2023
Comparison of classical and ab initio simulations of hydronium and aqueous proton transferManuela Maurer, Themis Lazaridis
Journal of Molecular Recognition : JMR|August 29, 2019
Water in protein hydration and ligand recognitionManuela Maurer, Chris Oostenbrink
Journal of Chemical Information and Modeling|November 14, 2023
Transmembrane β-Barrel Models of α-Synuclein OligomersManuela Maurer, Themis Lazaridis
Journal of Computational Chemistry|October 4, 2018
Comparison of free-energy methods using a tripeptide-water model systemManuela Maurer, Niels Hansen, Chris Oostenbrink
Journal of Computational Chemistry|September 17, 2016
Free-energy calculations of residue mutations in a tripeptide using various methods to overcome inefficient samplingMichael M H Graf, Manuela Maurer, Chris Oostenbrink
Langmuir : the ACS Journal of Surfaces and Colloids|October 30, 2012
Optimized loading and sustained release of hydrophilic proteins from internally nanostructured particlesAngela Chemelli, Manuela Maurer, Roman Geier, et al.
Molecules (Basel, Switzerland)|April 20, 2016
Calculation of Relative Binding Free Energy in the Water-Filled Active Site of Oligopeptide-Binding Protein AManuela Maurer, Stephanie B A de Beer, Chris Oostenbrink
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