Identification of Branched and Linear Forms of PFOA and Potential Precursors: A User-Friendly SMILES Structure-based Approach
Data files for "Identification of Branched and Linear Forms of PFOA and Potential Precursors: A User-Friendly SMILES Structure-based Approach".
This dataset is associated with the following publication:
Richard, A., H. Hidle, G. Patlewicz, and A. Williams. Identification of Branched and Linear Forms of PFOA and Potential Precursors: A User-Friendly SMILES Structure-based Approach. Frontiers in Environmental Science. Frontiers, Lausanne, SWITZERLAND, 10: 865488, (2022).
Resources
2 resources available
-
PFAS-SC-PFOAListing_Suppl_26Jan2022.xlsx
APPLICATION/VND.OPENXMLFORMATS-OFFICEDOCUMENT.SPREADSHEETML.SHEET -
PFOA-SMILES_macro_v1.0.xlsx
APPLICATION/VND.OPENXMLFORMATS-OFFICEDOCUMENT.SPREADSHEETML.SHEET
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Complete Metadata
| @type | dcat:Dataset |
|---|---|
| accessLevel | public |
| bureauCode |
[ "020:00" ] |
| contactPoint |
{ "fn": "Ann Richard", "hasEmail": "mailto:richard.ann@epa.gov" } |
| description | Data files for "Identification of Branched and Linear Forms of PFOA and Potential Precursors: A User-Friendly SMILES Structure-based Approach". This dataset is associated with the following publication: Richard, A., H. Hidle, G. Patlewicz, and A. Williams. Identification of Branched and Linear Forms of PFOA and Potential Precursors: A User-Friendly SMILES Structure-based Approach. Frontiers in Environmental Science. Frontiers, Lausanne, SWITZERLAND, 10: 865488, (2022). |
| distribution |
[ { "title": "PFAS-SC-PFOAListing_Suppl_26Jan2022.xlsx", "mediaType": "application/vnd.openxmlformats-officedocument.spreadsheetml.sheet", "downloadURL": "https://pasteur.epa.gov/uploads/10.23719/1526079/PFAS-SC-PFOAListing_Suppl_26Jan2022.xlsx" }, { "title": "PFOA-SMILES_macro_v1.0.xlsx", "mediaType": "application/vnd.openxmlformats-officedocument.spreadsheetml.sheet", "downloadURL": "https://pasteur.epa.gov/uploads/10.23719/1526079/PFOA-SMILES_macro_v1.0.xlsx" } ] |
| identifier | https://doi.org/10.23719/1526079 |
| keyword |
[ "DSSTox", "PFAS", "PFASSTRUCT", "PFOA", "SMILES", "branched", "linear" ] |
| license | https://pasteur.epa.gov/license/sciencehub-license.html |
| modified | 2022-01-28 |
| programCode |
[ "020:000" ] |
| publisher |
{ "name": "U.S. EPA Office of Research and Development (ORD)", "subOrganizationOf": { "name": "U.S. Environmental Protection Agency", "subOrganizationOf": { "name": "U.S. Government" } } } |
| references |
[ "https://doi.org/10.3389/fenvs.2022.865488" ] |
| rights |
null
|
| title | Identification of Branched and Linear Forms of PFOA and Potential Precursors: A User-Friendly SMILES Structure-based Approach |
