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21 to 30 of 46 Results
Walking Model(Universität Stuttgart)
Jul 31, 2023Institute for Modelling and Simulation of Biomechanical Systems
Replication Data for: A screening of results on the decay length in concentrated electrolytes
Jul 19, 2023 - SFB 1333 A3 - Schlaich group, ICP
Jäger, Henrik, 2023, "Replication Data for: A screening of results on the decay length in concentrated electrolytes", https://doi.org/10.18419/darus-3551, DaRUS, V1
This is the repository holding the inputs for atomistic Molecular Dynamics Simulations of nano-confined mica slabs as well as the outputs for cDFT calculations. Also, scripts for input generation and all analysis tools used are See the README file for more information.
Material for the paper "The possible role of lipid bilayer properties in the evolutionary disappearance of betaine lipids in seed plants."
Jul 18, 2023 - BLinK
Schlaich, Alexander, 2023, "Material for the paper "The possible role of lipid bilayer properties in the evolutionary disappearance of betaine lipids in seed plants."", https://doi.org/10.18419/darus-2360, DaRUS, V1
Simulation input scripts to produce the data presented in the manuscript "The possible role of lipid bilayer properties in the evolutionary disappearance of betaine lipids in seed plants." All simulations were carried out using the GROMACS simulation package. The folders contain...
Supplementary Material for 'Entropic barrier of water permeation through single-file channels'
Jun 30, 2023 - PN 3-11
Wachlmayr, Johann; Fläschner, Gotthold; Pluhackova, Kristyna; Sandtner, Walter; Siligan, Christine; Horner, Andreas, 2023, "Supplementary Material for 'Entropic barrier of water permeation through single-file channels'", https://doi.org/10.18419/darus-3390, DaRUS, V1
Facilitated water permeation through narrow biological channels is fundamental for all forms of life. This process involves dehydration of bulk water entering the single-file region and hydrogen bond formation with channel lining amino acid residues. Despite its significance in h...
Scripts and Data for "A Generalized Grand-Reaction-Method for Modelling the Exchange of Weak (Polyprotic) Acids between a Solution and a Weak Polyelectrolyte Phase"
Jun 29, 2023 - Holm group
Beyer, David; Holm, Christian, 2023, "Scripts and Data for "A Generalized Grand-Reaction-Method for Modelling the Exchange of Weak (Polyprotic) Acids between a Solution and a Weak Polyelectrolyte Phase"", https://doi.org/10.18419/darus-3255, DaRUS, V1
Simulation scripts, simulation data and plotting scripts for the paper "A Generalized Grand-Reaction-Method for Modelling the Exchange of Weak (Polyprotic) Acids between a Solution and a Weak Polyelectrolyte Phase". More information can be found in README.md. Some of the subdirec...
Replication Data for: Leveraging the compute power of two HPC systems for higher-dimensional grid-based simulations with the widely-distributed sparse grid combination technique
Replication Data for: Leveraging the compute power of two HPC systems for higher-dimensional grid-based simulations with the widely-distributed sparse grid combination technique
Jun 27, 2023 - Scientific Computing
Pollinger, Theresa, 2023, "Replication Data for: Leveraging the compute power of two HPC systems for higher-dimensional grid-based simulations with the widely-distributed sparse grid combination technique", https://doi.org/10.18419/darus-3393, DaRUS, V1
We ran different fractions of the combination technique scenario described in the publication, also widely-distributed between the two machines SuperMUC-NG (file suffix `_ng`) and Hawk (file suffix `_hawk`). The dataset contains input files to generate the scenarios on the respec...
Data for: Tracking the activity and position of mitochondrial beta-barrel proteins
Jun 21, 2023 - Biophysics Group
Wang, Shuo; Nussberger, Stephan, 2023, "Data for: Tracking the activity and position of mitochondrial beta-barrel proteins", https://doi.org/10.18419/darus-3573, DaRUS, V1
Total interference reflection fluorescence microscopy (TIRF) of lipid bilayers is an effective technique for studying the lateral motion and ion channel activity of individual integral membrane proteins by optical means. This dataset contains a demo video for tracking the activit...
SFB 1333 A3 - Schlaich group, ICP(Universität Stuttgart)
Jun 15, 2023SFB 1333 "Molecular heterogeneous catalysis in confined geometries"
BLinK(Universität Stuttgart)
Jun 7, 2023Membranes
Container for the BLinK project
Membranes(Universität Stuttgart)
Jun 7, 2023PN 1-8
Dataverse containig material on lipid membranes and surfaces interactions
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