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1 to 10 of 341 Results

Replication Data for: Capturing reduced-order quantum many-body dynamics out of equilibrium via neural ordinary differential equations Mar 23, 2026 - Coarse-grained non-equilibrium dynamics with generative machine learning Egenlauf, Patrick; Březinová, Iva; Andergassen, Sabine; Klopotek, Miriam, 2026, "Replication Data for: Capturing reduced-order quantum many-body dynamics out of equilibrium via neural ordinary differential equations", https://doi.org/10.18419/DARUS-5613, DaRUS, V2 This dataset contains all relevant data to reproduce the results of the paper titled "Capturing reduced-order quantum many-body dynamics out of equilibrium via neural ordinary differential equations". It contains the exact time series data of the two-particle reduced density matrix (2RDM) for each parameter configuration of the parameter scan, with...
Supplementary Data to: "Activation mechanism of the full-length histidine kinase LvrB from pathogenic Leptospira" Mar 20, 2026 - PN 3-11 Pluhackova, Kristyna; Hiller, Sebastian; Agustoni, Elia, 2026, "Supplementary Data to: "Activation mechanism of the full-length histidine kinase LvrB from pathogenic Leptospira"", https://doi.org/10.18419/DARUS-5664, DaRUS, V2 MD data (author K. Pluhackova): Initial coordinate and simulation input files and a coordinate files of the final outputs as well as of the simulation trajectories (protein only) for all-atom MD simulations of LvrB performed using CHARMM36m/TIP4p in GROMACS2023. (pdb, xtc) Simulation data on phosphorylated aspartic acid (residue APP) with parameter...
Replication Data for: Optimal information injection and transfer mechanisms for active matter reservoir computing (Gaimann and Klopotek, 2025) Mar 11, 2026 - PN 6-15 Gaimann, Mario U.; Klopotek, Miriam, 2025, "Replication Data for: Optimal information injection and transfer mechanisms for active matter reservoir computing (Gaimann and Klopotek, 2025)", https://doi.org/10.18419/DARUS-4805, DaRUS, V2, UNF:6:C1gH8zVD6YKFF/O3ZhSaSA== [fileUNF] This repository contains raw and post-processed replication data for the publication "Optimal information injection and transfer mechanisms for active matter reservoir computing" (Gaimann and Klopotek, 2025). The datasets contain physical observables recorded during non-equilibrium simulations of active matter systems (swarms) driven by an external...
Supplementary Videos for: Optimal information injection and transfer mechanisms for active matter reservoir computing (Gaimann and Klopotek, 2025) Mar 11, 2026 - PN 6-15 Gaimann, Mario U.; Klopotek, Miriam, 2025, "Supplementary Videos for: Optimal information injection and transfer mechanisms for active matter reservoir computing (Gaimann and Klopotek, 2025)", https://doi.org/10.18419/DARUS-4806, DaRUS, V2 This dataset contains supplementary videos for the publication "Optimal information injection and transfer mechanisms for active matter reservoir computing" (Gaimann and Klopotek, 2025) (to be published). The datasets contain physical observables recorded during non-equilibrium simulations of active matter systems (swarms) driven by an external for...
Replication Data for: Apax: A Flexible and Performant Framework For The Development of Machine-Learned Interatomic Potentials Mar 10, 2026 - PN 6A-3 Schäfer, Moritz; Segreto, Nico; Zills, Fabian; Holm, Christian; Kästner, Johannes, 2026, "Replication Data for: Apax: A Flexible and Performant Framework For The Development of Machine-Learned Interatomic Potentials", https://doi.org/10.18419/DARUS-5007, DaRUS, V1 This repository contains the data for our paper on "Apax: A Flexible and Performant Framework For The Development of Machine-Learned Interatomic Potentials". This includes both the simulation results as well as workflows and input files needed to recreate the results. Different experiments are contained on different branches and a more detailed REA...
PN 3 A-5(Universität Stuttgart) Mar 10, 2026PN 3 AI software tools for materials development
Data for: Excited State Opto-Ionic Reservoir Computing in Hybrid Perovskite Electrochemically-Gated Luminescent Cells Mar 3, 2026 - Deschler group Dataverse Kollenz, Philipp, 2026, "Data for: Excited State Opto-Ionic Reservoir Computing in Hybrid Perovskite Electrochemically-Gated Luminescent Cells", https://doi.org/10.18419/DARUS-5656, DaRUS, V1 This dataset contains measurement data related to the paper "Excited State Opto-Ionic Reservoir Computing in Hybrid Perovskite Electrochemically-Gated Luminescent Cells". The data originates from optical and electrical experiments investigating neuromorphic reservoir computing based on opto-ionic dynamics in hybrid lead-halide perovskite devices.Th...
Replication Data for: A framework for objectively comparing competing invasion percolation models based on highly-resolved image data Feb 23, 2026 - Modeling Strategies for Gas migration in Subsurface Banerjee, Ishani; Guthke (geb. Schöniger), Anneli; Nowak, Wolfgang, 2026, "Replication Data for: A framework for objectively comparing competing invasion percolation models based on highly-resolved image data", https://doi.org/10.18419/DARUS-3592, DaRUS, V1 This dataset contains the codes for the invasion percolation models and comparison method used in the manuscript: A framework for objectively comparing competing invasion percolation models based on highly-resolved image data
Matlab Code and Data for: Data-driven geometric parameter optimization for PD-GMRES Feb 19, 2026 - PN 5-13 Duvenbeck, Lennart; Riethmüller, Cedric; Rohde, Christian, 2025, "Matlab Code and Data for: Data-driven geometric parameter optimization for PD-GMRES", https://doi.org/10.18419/DARUS-4812, DaRUS, V2 This repository contains the Matlab code and generated data for the manuscript "Data-driven geometric parameter optimization for PD-GMRES" which uses a quadtree approach to optimize parameters for the iterative solver PD-GMRES. It includes hardware specific data to allow for reproducibity of our results. Our calculations were performed using MATLAB...
Supplementary Videos for: Robustly optimal dynamics for active matter reservoir computing (Gaimann and Klopotek, 2025) Feb 18, 2026 - PN 6-15 Gaimann, Mario U.; Klopotek, Miriam, 2025, "Supplementary Videos for: Robustly optimal dynamics for active matter reservoir computing (Gaimann and Klopotek, 2025)", https://doi.org/10.18419/DARUS-4619, DaRUS, V2 This dataset contains supplementary videos for the publication "Robustly optimal dynamics for active matter reservoir computing" (Gaimann and Klopotek, 2025) The videos show active matter systems (swarms) driven by an external force. These swarm systems can be used to predict the future trajectory of the external driving force using reservoir compu...

Replication Data for: Capturing reduced-order quantum many-body dynamics out of equilibrium via neural ordinary differential equations

Mar 23, 2026 - Coarse-grained non-equilibrium dynamics with generative machine learning

Egenlauf, Patrick; Březinová, Iva; Andergassen, Sabine; Klopotek, Miriam, 2026, "Replication Data for: Capturing reduced-order quantum many-body dynamics out of equilibrium via neural ordinary differential equations", https://doi.org/10.18419/DARUS-5613, DaRUS, V2

This dataset contains all relevant data to reproduce the results of the paper titled "Capturing reduced-order quantum many-body dynamics out of equilibrium via neural ordinary differential equations". It contains the exact time series data of the two-particle reduced density matrix (2RDM) for each parameter configuration of the parameter scan, with...

Supplementary Data to: "Activation mechanism of the full-length histidine kinase LvrB from pathogenic Leptospira"

Mar 20, 2026 - PN 3-11

Pluhackova, Kristyna; Hiller, Sebastian; Agustoni, Elia, 2026, "Supplementary Data to: "Activation mechanism of the full-length histidine kinase LvrB from pathogenic Leptospira"", https://doi.org/10.18419/DARUS-5664, DaRUS, V2

MD data (author K. Pluhackova): Initial coordinate and simulation input files and a coordinate files of the final outputs as well as of the simulation trajectories (protein only) for all-atom MD simulations of LvrB performed using CHARMM36m/TIP4p in GROMACS2023. (pdb, xtc) Simulation data on phosphorylated aspartic acid (residue APP) with parameter...

Replication Data for: Optimal information injection and transfer mechanisms for active matter reservoir computing (Gaimann and Klopotek, 2025)

Mar 11, 2026 - PN 6-15

Gaimann, Mario U.; Klopotek, Miriam, 2025, "Replication Data for: Optimal information injection and transfer mechanisms for active matter reservoir computing (Gaimann and Klopotek, 2025)", https://doi.org/10.18419/DARUS-4805, DaRUS, V2, UNF:6:C1gH8zVD6YKFF/O3ZhSaSA== [fileUNF]

This repository contains raw and post-processed replication data for the publication "Optimal information injection and transfer mechanisms for active matter reservoir computing" (Gaimann and Klopotek, 2025). The datasets contain physical observables recorded during non-equilibrium simulations of active matter systems (swarms) driven by an external...

Supplementary Videos for: Optimal information injection and transfer mechanisms for active matter reservoir computing (Gaimann and Klopotek, 2025)

Mar 11, 2026 - PN 6-15

Gaimann, Mario U.; Klopotek, Miriam, 2025, "Supplementary Videos for: Optimal information injection and transfer mechanisms for active matter reservoir computing (Gaimann and Klopotek, 2025)", https://doi.org/10.18419/DARUS-4806, DaRUS, V2

This dataset contains supplementary videos for the publication "Optimal information injection and transfer mechanisms for active matter reservoir computing" (Gaimann and Klopotek, 2025) (to be published). The datasets contain physical observables recorded during non-equilibrium simulations of active matter systems (swarms) driven by an external for...

Replication Data for: Apax: A Flexible and Performant Framework For The Development of Machine-Learned Interatomic Potentials

Mar 10, 2026 - PN 6A-3

Schäfer, Moritz; Segreto, Nico; Zills, Fabian; Holm, Christian; Kästner, Johannes, 2026, "Replication Data for: Apax: A Flexible and Performant Framework For The Development of Machine-Learned Interatomic Potentials", https://doi.org/10.18419/DARUS-5007, DaRUS, V1

This repository contains the data for our paper on "Apax: A Flexible and Performant Framework For The Development of Machine-Learned Interatomic Potentials". This includes both the simulation results as well as workflows and input files needed to recreate the results. Different experiments are contained on different branches and a more detailed REA...

PN 3 A-5(Universität Stuttgart)

Mar 10, 2026PN 3

AI software tools for materials development

Data for: Excited State Opto-Ionic Reservoir Computing in Hybrid Perovskite Electrochemically-Gated Luminescent Cells

Mar 3, 2026 - Deschler group Dataverse

Kollenz, Philipp, 2026, "Data for: Excited State Opto-Ionic Reservoir Computing in Hybrid Perovskite Electrochemically-Gated Luminescent Cells", https://doi.org/10.18419/DARUS-5656, DaRUS, V1

This dataset contains measurement data related to the paper "Excited State Opto-Ionic Reservoir Computing in Hybrid Perovskite Electrochemically-Gated Luminescent Cells". The data originates from optical and electrical experiments investigating neuromorphic reservoir computing based on opto-ionic dynamics in hybrid lead-halide perovskite devices.Th...

Replication Data for: A framework for objectively comparing competing invasion percolation models based on highly-resolved image data

Feb 23, 2026 - Modeling Strategies for Gas migration in Subsurface

Banerjee, Ishani; Guthke (geb. Schöniger), Anneli; Nowak, Wolfgang, 2026, "Replication Data for: A framework for objectively comparing competing invasion percolation models based on highly-resolved image data", https://doi.org/10.18419/DARUS-3592, DaRUS, V1

This dataset contains the codes for the invasion percolation models and comparison method used in the manuscript: A framework for objectively comparing competing invasion percolation models based on highly-resolved image data

Matlab Code and Data for: Data-driven geometric parameter optimization for PD-GMRES

Feb 19, 2026 - PN 5-13

Duvenbeck, Lennart; Riethmüller, Cedric; Rohde, Christian, 2025, "Matlab Code and Data for: Data-driven geometric parameter optimization for PD-GMRES", https://doi.org/10.18419/DARUS-4812, DaRUS, V2

This repository contains the Matlab code and generated data for the manuscript "Data-driven geometric parameter optimization for PD-GMRES" which uses a quadtree approach to optimize parameters for the iterative solver PD-GMRES. It includes hardware specific data to allow for reproducibity of our results. Our calculations were performed using MATLAB...

Supplementary Videos for: Robustly optimal dynamics for active matter reservoir computing (Gaimann and Klopotek, 2025)

Feb 18, 2026 - PN 6-15

Gaimann, Mario U.; Klopotek, Miriam, 2025, "Supplementary Videos for: Robustly optimal dynamics for active matter reservoir computing (Gaimann and Klopotek, 2025)", https://doi.org/10.18419/DARUS-4619, DaRUS, V2

This dataset contains supplementary videos for the publication "Robustly optimal dynamics for active matter reservoir computing" (Gaimann and Klopotek, 2025) The videos show active matter systems (swarms) driven by an external force. These swarm systems can be used to predict the future trajectory of the external driving force using reservoir compu...

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