Data · dataset · 2024
QM/MM modeling of the mechanism of the reduction of FAD by NADPH at the active site of human glutathione reductase
Listed in Redata
Input files for geometry optimization of stable species and transition states with tcl-ChemShell; AMBER coordinates and topologies used for QM/MM calculations; input files for reaction coordinate scan.
Links
Where it is published
- Dataverse dataset page redata.anii.org.uy/dataset.xhtml?persistentId=doi%3A10.60895%2Fredata%2FEJDCVY ↗
landing page · from redata anii org uy
- DOI doi.org/10.60895/redata/ejdcvy ↗
DOI / persistent id · from redata anii org uy
Catalogue records · 1
- Dataverse API redata.anii.org.uy/api/datasets/:persistentId/?persistentId=doi%3A10.60895%2Freda… ↗
metadata API · from redata anii org uy
Topics
- Stated by source
- Ciencias médicas, de la salud y de la vida · Química
- From keywords
- Life Sciences · Medicine & Health · Physics
- Inferred from text
- Biochemistry and cell biology 72%
Provenance · 1 source records, 12 field assertions
| Source | Key | Last seen | Raw |
|---|---|---|---|
| Redata | doi:10.60895/redata/EJDCVY | 13 d ago | JSON v1 |
| Field | Assertion | Extractor | Evidence |
|---|---|---|---|
| concepts[field].anzsrc:group:3101 | enrichment · redata anii org uy | taxonomy-embedding@1.1.0 | title+keywords+description (72%) |
| concepts[field].dataverse_subject:ciencias-m-dicas-de-la-salud-y-de-la-vida | source · redata anii org uy | connector:redata_anii_org_uy@1.0.0 | /subjects |
| concepts[field].dataverse_subject:qu-mica | source · redata anii org uy | connector:redata_anii_org_uy@1.0.0 | /subjects |
| concepts[field].local:field:life-sciences | mapping · redata anii org uy | connector:redata_anii_org_uy@1.0.0 | /subjects |
| concepts[field].local:field:medicine-health | mapping · redata anii org uy | connector:redata_anii_org_uy@1.0.0 | /subjects |
| concepts[field].local:field:physics | mapping · redata anii org uy | connector:redata_anii_org_uy@1.0.0 | /subjects |
| created_date | source · redata anii org uy | connector:redata_anii_org_uy@1.0.0 | |
| description | source · redata anii org uy | connector:redata_anii_org_uy@1.0.0 | /description |
| publication_date | source · redata anii org uy | connector:redata_anii_org_uy@1.0.0 | |
| title | source · redata anii org uy | connector:redata_anii_org_uy@1.0.0 | /name |
| updated_date | source · redata anii org uy | connector:redata_anii_org_uy@1.0.0 | |
| version_label | source · redata anii org uy | connector:redata_anii_org_uy@1.0.0 |