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Development of chemical categories for per- and polyfluoroalkyl substances (PFAS) and the proof-of-concept approach to the identification of potential candidates for tiered toxicological testing and human health assessment

Published by U.S. EPA Office of Research and Development (ORD) | U.S. Environmental Protection Agency | Catalog Last Checked: August 03, 2026 at 12:51 AM | Dataset Last Updated: August 07, 2024
Data processing was conducted using the Anaconda distribution of Python 3.9 and associated libraries. Jupyter notebooks are available at https://github.com/patlewig/nts_pfas. Datasets supporting the manuscript are accessible at https://doi.org/10.23645/epacomptox.26524327. This dataset is associated with the following publication: Patlewicz, G., R. Judson, A. Williams, T. Butler, S. Barone, K. Carstens, J. Cowden, J. Dawson, S. Degitz, K. Fay, A. Lowit, S. Padilla, K. Friedman, M. Phillips, D. Turk, J. Wambaugh, B. Wetmore, and R. Thomas. Development of chemical categories for per- and polyfluoroalkyl substances (PFAS) and the proof-of-concept approach to the identification of potential candidates for tiered toxicological testing and human health assessment. Computational Toxicology. Elsevier B.V., Amsterdam, NETHERLANDS, 31: 100327, (2024).

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  • https://clowder.edap-cluster.com/datasets/61147fefe4b0856fdc65639b#folderId=66b52127e4b0a7c65d2a096d

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  • https://doi.org/10.23645/epacomptox.26524327

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  • https://github.com/patlewig/nts_pfas

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  • 1-s2.0-S246811132400029X-mmc1.docx

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  • 1-s2.0-S246811132400029X-mmc2.zip

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Complete Metadata
@type dcat:Dataset
accessLevel public
bureauCode 
[
  "020:00"
]
contactPoint 
{
  "fn": "Grace Patlewicz",
  "hasEmail": "mailto:patlewicz.grace@epa.gov"
}
description Data processing was conducted using the Anaconda distribution of Python 3.9 and associated libraries. Jupyter notebooks are available at https://github.com/patlewig/nts_pfas. Datasets supporting the manuscript are accessible at https://doi.org/10.23645/epacomptox.26524327. This dataset is associated with the following publication: Patlewicz, G., R. Judson, A. Williams, T. Butler, S. Barone, K. Carstens, J. Cowden, J. Dawson, S. Degitz, K. Fay, A. Lowit, S. Padilla, K. Friedman, M. Phillips, D. Turk, J. Wambaugh, B. Wetmore, and R. Thomas. Development of chemical categories for per- and polyfluoroalkyl substances (PFAS) and the proof-of-concept approach to the identification of potential candidates for tiered toxicological testing and human health assessment. Computational Toxicology. Elsevier B.V., Amsterdam, NETHERLANDS, 31: 100327, (2024).
distribution 
[
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    "title": "https://clowder.edap-cluster.com/datasets/61147fefe4b0856fdc65639b#folderId=66b52127e4b0a7c65d2a096d",
    "accessURL": "https://clowder.edap-cluster.com/datasets/61147fefe4b0856fdc65639b#folderId=66b52127e4b0a7c65d2a096d"
  },
  {
    "title": "https://doi.org/10.23645/epacomptox.26524327",
    "accessURL": "https://doi.org/10.23645/epacomptox.26524327"
  },
  {
    "title": "https://github.com/patlewig/nts_pfas",
    "accessURL": "https://github.com/patlewig/nts_pfas"
  },
  {
    "title": "1-s2.0-S246811132400029X-mmc1.docx",
    "mediaType": "application/vnd.openxmlformats-officedocument.wordprocessingml.document",
    "downloadURL": "https://pasteur.epa.gov/uploads/10.23719/1531729/1-s2.0-S246811132400029X-mmc1.docx"
  },
  {
    "title": "1-s2.0-S246811132400029X-mmc2.zip",
    "mediaType": "application/zip",
    "downloadURL": "https://pasteur.epa.gov/uploads/10.23719/1531729/1-s2.0-S246811132400029X-mmc2.zip"
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]
identifier https://doi.org/10.23719/1531729
keyword 
[
  "NAM",
  "PFAS",
  "Read-across",
  "categories"
]
license https://pasteur.epa.gov/license/sciencehub-license.html
modified 2024-08-07
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/10.1016/j.comtox.2024.100327"
]
rights 
null
title Development of chemical categories for per- and polyfluoroalkyl substances (PFAS) and the proof-of-concept approach to the identification of potential candidates for tiered toxicological testing and human health assessment

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