Automated evaluation of consistency within the PubChem Compound database

Identification of discrepant data in aggregated databases is a key step in data curation and remediation. We have applied the ALATIS approach, which is based on the international chemical shift identifier (InChI) model, to the full PubChem Compound database to generate unique and reproducible compou...

Descripción completa

Detalles Bibliográficos
Autores principales: Dashti, Hesam, Wedell, Jonathan R., Westler, William M., Markley, John L., Eghbalnia, Hamid R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group 2019
Materias:
Analysis
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6380220/
https://www.ncbi.nlm.nih.gov/pubmed/30778259
http://dx.doi.org/10.1038/sdata.2019.23

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6380220/
https://www.ncbi.nlm.nih.gov/pubmed/30778259
http://dx.doi.org/10.1038/sdata.2019.23

Ejemplares similares