641 to 650 of 3,486 Results
Jan 19, 2026 - SFB 1333 C4 - Kästner group, ITheoC
Haid, Severin; Kästner, Johannes, 2026, "Replication Data for: Correlating the Reactivity of Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes in Ene-Yne Metathesis and Cyclopolymerization", https://doi.org/10.18419/DARUS-5600, DaRUS, V1
In this dataset, all simulation data are listed. The reaction mechanism for a cycloisomerization for the metathesis polymerization for Molybdenum Imido Alkylidene NHC catalysts was investigated using quantum chemical methods. All intermediates for two reaction paths, and one catalyst, were calculated and are given in the directory "Cat3_comp". For... |
Jan 19, 2026 - SFB 1333 C4 - Kästner group, ITheoC
Haid, Severin; Gugeler, Katrin; Beck, Alexander; Kästner, Johannes, 2026, "Replication Data for: Chiral Rh diene NHC Complexes and their Application in Rh-Catalyzed Cycloisomerization of Enynes", https://doi.org/10.18419/DARUS-5643, DaRUS, V1
In this dataset, all simulation data are listed. The reaction mechanism for a cycloisomerization using an NHC Diene Rhodium catalyst was investigated using quantum chemical methods. All relevant intermediates and transition states were calculated for two different paths and two different NHCs, respectively. This includes geometry optimizations, ene... |
Jan 16, 2026 - SFB 1333 C4 - Kästner group, ITheoC
Haid, Severin; Kästner, Johannes, 2026, "Replication Data for: Tuning Regioselectivity in Cyclopolymerization through Carbene Ligand Size Modulation in Molybdenum Imido Alkylidene Catalysts", https://doi.org/10.18419/DARUS-5601, DaRUS, V1, UNF:6:0oSw6+PTOBrLaZ7L1EFQYg== [fileUNF]
In this dataset, all simulation data are listed. That includes all geometry optimizations and, where relevant, energy and/or partial charge calculations. All structures are named "*.xyz", the input files are named "*.chm", and the output files are named "out". The names of the catalysts are different in the simulations than the ones used in the pap... |
Jan 16, 2026 - Institute of Thermodynamics and Thermal Process Engineering
Burkhardt, Julia; Bauer, Gernot; Stierle, Rolf; Gross, Joachim, 2026, "Supplementary Material for: A New Group-Contribution Approach for Ideal Gas Heat Capacity, Critical Temperature and Normal Boiling Point", https://doi.org/10.18419/DARUS-5298, DaRUS, V1, UNF:6:nPSGKxgf2iHw5a00gUAPRg== [fileUNF]
This dataset contains the substances used in in the related publication (.csv files), the adjusted group contribution parameters for the ideal gas heat capacity, the normal boiling point and the critical temperature, individually adjusted ideal gas heat capacity parameters (.csv files), the first and second order candidate groups (.py files) and py... |
Jan 14, 2026 - Amplicon based bisulfite NGS data
Jeltsch, Albert, 2026, "Sequencing data related to Gutekunst et al. "Nucleosome linker DNA methylation by DNMT3A/DNMT3B3 is controlled by nucleosome binding and multimerization of DNMT3 complexes on DNA"", https://doi.org/10.18419/DARUS-5490, DaRUS, V1
Methods DNA libraries for Illumina NGS were prepared with a two-step PCR approach. For this, the Nucleosome 1 - Linker - Nucleosome 2 sequence was split into two amplicons, one comprising the Nucleosome 1 - Linker and the second comprising Linker - Nucleosome 2. For library preparation, 1 μL of bisulfite-converted DNA was amplified in a first PCR r... |
Jan 14, 2026 - EXC IntCDC RP 9.2: Data Processing and AI for Predictive and Adaptive Co-Design
Skoury, Lior; Leder, Samuel, 2026, "Digital Twin task logs for Collective Robotic Construction (CRC) — ROB|ARCH 2024", https://doi.org/10.18419/DARUS-5612, DaRUS, V1
Digital Twin task logs for Collective Robotic Construction (CRC) — ROB|ARCH 2024 Digital Twin task logs for Collective Robotic Construction (CRC) — ROB|ARCH 2024 Overview This repository contains a dataset of Digital Twin (DT) task logs from a Collective Robotic Construction (CRC) workshop held at ROB|ARCH 2024. Over three days, 14 participants pro... |
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Jan 8, 2026 - SFB 1333 A4 - Bruckner group
Itzigehl, Selina; Ott, Tom; Ströhle, Anne-Kathrin; Nguyen, Hoang-Huy; Roham Talei Jeid; Ay, Nağme; Terban, Maxwell; Dyballa, Michael; Schmitz, Guido; Estes, Deven; Bruckner, Johanna R., 2026, "Replication data for: "Efficient synthesis of well-defined ordered mesoporous aluminosilicates with tailorable acidity"", https://doi.org/10.18419/DARUS-5164, DaRUS, V1, UNF:6:Cznj/4TwbYhva1j9oY94ew== [fileUNF]
This dataset contains all primary and/or processed data underlying the publication "Efficient synthesis of well-defined ordered mesoporous aluminosilicates with tailorable acidity". The publication reports the synthesis and characterization of ordered mesoporous aluminosilicates by direct liquid crystal templating. Take a look at the publication Da... |
Jan 7, 2026 - Institute for Theoretical Physics IV
Speck, Thomas; Robinson, Joshua; Hertäg, Kathrin, 2026, "Supporting data for 'Statistics and morphologies of stable droplets in scalar active fluids'", https://doi.org/10.18419/DARUS-5366, DaRUS, V1
Processed data simulation data were used to produce the figures of the accompanying paper. With the given data, the figures in the paper are completely reproducible. The given data is produces by doing simulations of AMB+. Afterwards the trajectories and the founded droplets are characterized. The outcome of this characterization is plotted and can... |
Dec 23, 2025 - Walking Model
Bunz, Elsa; Häufle, Daniel F B; Schmitt, Syn; Geijtenbeek, Thomas, 2025, "Repository for "A spinal network of proprioceptive reflexes can produce a variety of bipedal gaits"", https://doi.org/10.18419/DARUS-4176, DaRUS, V1
This dataset contains the files for "A spinal network of proprioceptive reflexes can produce a variety of bipedal gaits" (E.K. Bunz, D.F.B. Haeufle, S. Schmitt, T. Geijtenbeek, DOI: 10.1038/s42003-025-09307-x). Always cite the paper together with this dataset. A valid Hyfydy license is required to run the files. Please consult the README for detail... |
