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MD Simulations with PRDM9 Dataset
This data collection contains additional data related to Graf et al.: "Investigation and design of the dual specificity of the PRDM9 protein lysine methyltransferase". This... -
Replication Data for: "Crystalline porous frameworks based on double extensio... Dataset
All primary data files of the journal article mentioned can be found here. The data is structured by materials. The characterization data of each material are located in the... -
Replication Data for: Using Support Effects to Increase the Productivity of I... Dataset
Replication data for the paper: Using Support Effects to Increase the Productivity of Immobilized Ruthenium Hydride Catalysts for the Hydrogenation of CO2. Contains NMR and IR... -
Supplementary material for ''Ring-Expansion Metathesis Polymerization under C... Dataset
This dataset contains simulation input files, topologies and coordinate files in GROMACS format accompanying the mentioned publication. With the provided Jupyter notebooks the... -
Replication Data of B3 for: "Asymmetric Rh Diene Catalysis under Confinement:... Dataset
In this dataset HPLC (high performance liquid chromatography) chromatograms and NMR (nuclear magnetic resonance) spectra of all newly prepared ligands, catalysts and catalysis... -
NGS data related to Sogl et al. "Systematic analysis of specificities and fla... Dataset
Analysis of flanking sequence preference with a randomized substrate and bioinformatic data For analysis of the flanking sequence preference, substrate with different target... -
Data for: Atomistic modeling of bulk and grain boundary diffusion in solid el... Dataset
The data in this repository support the findings presented in the article "Atomistic modeling of bulk and grain boundary diffusion in solid electrolyte Li6PS5Cl using... -
Scripts and data for "Calculation of 1H-NMR relaxation rates from a model uni... Dataset
Simulations and data analysis scripts for the publication "Calculation of 1H-NMR relaxation rates from a model united-atom alkanes using reverse coarse-graining". Within... -
Supplementary material for "Influence of water content on thermophysical prop... Dataset
This dataset contains force field files in GROMACS format accompanying the mentioned publication. The topology file is given for one specific composition and can be adapted by... -
Supplementary Data for 'Vastly different energy landscapes of the membrane in... Dataset
Simulation files, molecular structures and trajectories, and jupyter notebooks used for analysis underlaying our publication on membrane insertion of monomeric gasdermin D to E.... -
Replication Data for: Grassmann Extrapolation for Accelerating Geometry Optim... Dataset
Data for reproducibility of the numerical simulations of the research paper: Grassmann Extrapolation for Accelerating Geometry Optimization -
Replication Data for: Fully guaranteed and computable error bounds on the ene... Dataset
Data for reproducibility of the numerical simulations of the research paper "Fully guaranteed and computable error bounds on the energy for periodic Kohn-Sham equations with... -
Replication Data for: "Influence of Water Content on Speciation and Phase For... Dataset
All primary data files of the journal article mentioned can be found here. The data is structured by the measurement techniques in the subfolders "PXRD", "TGA", "NMR", "PDF",... -
Data for: Pros and cons of airlift and bubble column bioreactors: How interna... Dataset
The DaRUS repository entails the simulation data for the publication "Pros and cons of airlift and bubble column bioreactors: How internals improve performance". Gas... -
Data Supplement (PhD Thesis Cicac-Hudi, Mario) Dataset
The document contains the Data supplement to the PhD Thesis of Cicac-Hudi, Mario. The document contains representations of processed spectroscopic data (NMR spectra, FTIR... -
Replication Data for: High-resolution cw laser spectroscopy of long-lived Ryd... Dataset
This dataset holds all measurement data, as well as the evaluation and plotting scripts to replicate all figures of the paper. Please refer to the README.md file for more... -
Data for Hydrogen Spillover through Hydride Transfer: The Reaction of ZnO and... Dataset
The data set contains TEM images, XAS data, EPR data, MAS NMR data and NMR data of zinc oxide and zirconium oxide samples before and after treatment with molecular metal hydrides. -
Replication Data for: Wetting behavior in the inertial phase of droplet impac... Dataset
Replication Data for: Wetting behavior in the inertial phase of droplet impacts onto sub-millimeter microstructured surfaces, published in the Journal of Colloid and Interface... -
Replication data of Buchmeiser group for: "Synthetic and Structural Peculiari... Dataset
All primary data files related to the publication. Procedures, recation conditions and used analytical equipment is discussed in detail in the experimental section or the... -
Code for training and using the droplet segmentation models Dataset
This dataset contains the necessary code for using our spray segmentation model used in the paper, Machine learning based spray process quantification. More information can be...
