Find research datasets worth reusing
Search datasets from major research repositories and use ShareScore to quickly assess how well each record supports discovery, access, and reuse.
2
datasets available to search
ShareScore release 0.9.0
Dataset results
2 results for “Kremer-Grest”
Equilibrated Kremer-Grest polymer melts of M=500 linear chains with Z=100 entanglements for varying chain stiffness.
<p>Kremer-Grest model polymer melts of highly entangled linear chains. Each melt has approximately 500 chains of Z=100 entanglements each. Systems have been generated for integer and half-integer stiffness kappa=-2.0 to 6.0. System sizes range from 8M to 2M beads.</p> <p>For details regarding the equilibration process and the Kremer-Grest polymer model see C. Svaneborg & R. Everaers ""Multiscale equilibration of highly entangled isotropic model polymer melts" J. Chem. Phys. 158, 054903 (2023) <a href="https://doi.org/10.1063/5.0123431">https://doi.org/10.1063/5.0123431</a></p> <p>Filenames denote the kappa<value> used when equilibrating the melt as well as the number of entanglements Z<number> and the number of molecules M<number>. The files are in ASCII format in the format of a LAMMPS data files. (https://lammps.sandia.gov) The semantics is self-explanatory, sections contains id, molecule, unwrapped coordinates of all beads, as well as bond and angular interactions between all beads.</p> <p>We acknowledge that part of the results of this research was obtained using the PRACE Research Infrastructure resource Joliot-Curie SKL based in France at GENCI@CEA. Computing facilities were provided by the eScience Center at the University of Southern Denmark and financed by the Faculty of Science.</p> <p>Please cite as:</p> <p>@article{MultiscaleEquilibrationHighlyEntangledIsotropicModelPolymerMelts,<br> author = {Svaneborg,Carsten and Everaers,Ralf },<br> title = {Multiscale equilibration of highly entangled isotropic model polymer melts},<br> journal = {J. Chem. Phys.},<br> volume = {158},<br> number = {5},<br> pages = {054903},<br> year = {2023},<br> doi = {10.1063/5.0123431},</p> <p> URL = {https://doi.org/10.1063/5.0123431}</p> <p>}<br> </p> <pre>@misc{EquilibratedKGMeltsZ100, author = {Svaneborg,Carsten and Everaers,Ralf}, title = {Equilibrated Kremer-Grest polymer melts of M=500 linear chains with Z=100 entanglements for varying chain stiffness.}, month = feb, year = 2023, publisher = {Zenodo}, version = {1.0}, doi = {10.5281/zenodo.7319837}, url = {https://doi.org/10.5281/zenodo.7319837} }</pre>
Equilibrated Kremer-Grest polymer melts of M=1000 linear chains with Z=200 entanglements for varying chain stiffness
<p>Kremer-Grest model polymer melts of highly entangled linear chains. Each melt has approximately 1000 chains of Z=200 entanglements each. Systems have been generated for integer and half-integer stiffness kappa=-2.0 to 6.0. System sizes range from 25M to 2M beads.</p> <p>For details regarding the equilibration process and the Kremer-Grest polymer model see C. Svaneborg & R. Everaers ""Multiscale equilibration of highly entangled isotropic model polymer melts" J. Chem. Phys. 158, 054903 (2023) <a href="https://doi.org/10.1063/5.0123431">https://doi.org/10.1063/5.0123431</a></p> <p>Filenames denote the kappa<value> used when equilibrating the melt as well as the number of entanglements Z<number> and the number of molecules M<number>. The files are in ASCII format in the format of a LAMMPS data file. (https://lammps.sandia.gov) The semantics is self-explanatory, sections contains id, molecule, unwrapped coordinates of all beads, as well as bond and angular interactions between all beads.</p> <p>We acknowledge that part of the results of this research was obtained using the PRACE Research Infrastructure resource Joliot-Curie SKL based in France at GENCI@CEA. Computing facilities were provided by the eScience Center at the University of Southern Denmark and financed by the Faculty of Science.</p> <p>Please cite as:</p> <p>@article{MultiscaleEquilibrationHighlyEntangledIsotropicModelPolymerMelts,<br> author = {Svaneborg,Carsten and Everaers,Ralf },<br> title = {Multiscale equilibration of highly entangled isotropic model polymer melts},<br> journal = {J. Chem. Phys.},<br> volume = {158},<br> number = {5},<br> pages = {054903},<br> year = {2023},<br> doi = {10.1063/5.0123431},</p> <p> URL = {https://doi.org/10.1063/5.0123431}</p> <p>}</p> <pre>@misc{EquilibratedKGMeltsZ200, author = {Svaneborg,Carsten and Everaers,Ralf}, title = {Equilibrated Kremer-Grest polymer melts of M=1000 linear chains with Z=200 entanglements for varying chain stiffness.}, month = feb, year = 2023, publisher = {Zenodo}, version = {1.0}, doi = {10.5281/zenodo.7034881}, url = {https://doi.org/10.5281/zenodo.7034881} }</pre>
ScienceDex guides
Understand access before you commit
These curated guides explain access requirements, typical timelines, costs, and reuse considerations for widely used research datasets.
Allen Brain Atlas
Allen Brain Atlas is an Allen Institute collection of brain map atlases, datasets, APIs, and analysis tools covering mouse, human, and non-human primate brain resources.
Annotated Behaviour and Observability Dataset (ABODe)
ABODe is a University of Edinburgh DataShare dataset for behavior classification in group-housed mice using home-cage video, identities, bounding boxes, ground-plate positions, and annotator labels.
DANDI Archive for NWB datasets
DANDI is a BRAIN Initiative archive for publishing and sharing neurophysiology data, including electrophysiology, optophysiology, and behavioral data packaged as NWB and related standards.
International Brain Laboratory public data
The International Brain Laboratory public data releases expose standardized mouse decision-making experiments, including Neuropixels recordings, widefield calcium imaging, behavior, and session metadata accessed through the ONE API.
OpenNeuro
OpenNeuro is a free, open platform for sharing neuroimaging datasets, with public search, dataset pages, and download paths for web, S3, DataLad, and the OpenNeuro CLI.