Data · dataset · 2013
Simulations files for the article "Molecular conformation and bilayer pores in a nonionic surfactant lamellar phase studies with 13C-1H solid-state NMR and molecular dynamics simulations"
Listed in DataCite
Description
Simulations files for the article "Molecular Conformation and Bilayer Pores in a Nonionic Surfactant Lamellar Phase Studied with 1H–13C Solid-State NMR and Molecular Dynamics Simulations" Ferreira et al. Langmuir, 2014, 30 (2), pp 461–469 dx.doi.org/10.1021/la404684r The simulation trajectories can be found from: 60 wt% C12E5, T=298K dx.doi.org/10.5281/zenodo.28595 60 wt% C12E5, T=320K dx.doi.org/10.5281/zenodo.28637 60 wt% C12E5, T=333K dx.doi.org/10.5281/zenodo.28638 70 wt% C12E5, T=298K dx.doi.org/10.5281/zenodo.20368 70 wt% C12E5, T=320K dx.doi.org/10.5281/zenodo.20561 70 wt% C12E5, T=333K dx.doi.org/10.5281/zenodo.20664 80 wt% C12E5, T=298K dx.doi.org/10.5281/zenodo.20221
Links
Where it is published
- Repository landing page figshare.com/articles/dataset/Simulations_files_for_the_article_Molecular_c… ↗
landing page · from DataCite
- Repository landing page figshare.com/articles/dataset/Simulations_files_for_the_article_Molecular_c… ↗
landing page · from DataCite
- DOI doi.org/10.6084/m9.figshare.861071 ↗
DOI / persistent id · from DataCite
- DOI doi.org/10.6084/m9.figshare.861071.v1 ↗
DOI / persistent id · from DataCite
Documentation and papers
Catalogue records · 4
- DataCite API api.datacite.org/dois/10.6084/m9.figshare.861071 ↗
metadata API · from DataCite
- DataCite API api.datacite.org/dois/10.6084/m9.figshare.861071.v1 ↗
metadata API · from DataCite
- DataCite Commons commons.datacite.org/doi.org/10.6084/m9.figshare.861071.v1 ↗
catalogue entry · from DataCite
- DataCite Commons commons.datacite.org/doi.org/10.6084/m9.figshare.861071 ↗
catalogue entry · from DataCite
Topics
- Stated by source
- Physical sciences · Physical sciences
- Inferred from text
- Simulation 75%
Provenance · 2 source records, 11 field assertions
| Source | Key | Last seen | Raw |
|---|---|---|---|
| DataCite | 10.6084/m9.figshare.861071 | 15 d ago | JSON v1 |
| DataCite | 10.6084/m9.figshare.861071.v1 | 15 d ago | JSON v1 |
| Field | Assertion | Extractor | Evidence |
|---|---|---|---|
| access_level | source · DataCite | connector:datacite@1.0.0 | /data/attributes/rightsList |
| byte_size | source · DataCite | connector:datacite@1.0.0 | |
| concepts[field].fos:physical-sciences | source · DataCite | connector:datacite@1.0.0 | |
| concepts[field].fos:physical-sciences | source · DataCite | connector:datacite@1.0.0 | |
| concepts[method].local:method:simulation | enrichment · DataCite | keyword-concept-rules@1.0.0 | title+description (75%) |
| created_date | source · DataCite | connector:datacite@1.0.0 | |
| description | source · DataCite | connector:datacite@1.0.0 | /data/attributes/descriptions |
| license | source · DataCite | connector:datacite@1.0.0 | /data/attributes/rightsList |
| publication_date | source · DataCite | connector:datacite@1.0.0 | /data/attributes/dates |
| title | source · DataCite | connector:datacite@1.0.0 | /data/attributes/titles/0/title |
| updated_date | source · DataCite | connector:datacite@1.0.0 |