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- Datasets.zul?datasetID=ds14 type Dataset assertion.
- Datasets.zul?datasetID=ds14 created "25 July 2025" assertion.
- Datasets.zul?datasetID=ds14 description "A curated and enriched dataset focused on the skin irritation potential of small organic molecules. Data were retrieved from the Registration, Evaluation, Authorization and Restriction of Chemicals (REACH) database, and were curated as part of the study by Borba et al. (https://ehp.niehs.nih.gov/doi/10.1289/EHP9341). The final dataset comprises 1,011 unique compounds, classified as skin irritants (label 1) and non- irritants (label 0). Data are enriched with 1,165 Mordred descriptors, as well as MACCS and Morgan fingerprints derived from their 2D molecular structures. Information on the compounds CAS, CID, InChIKey etc. are also included whenever possible, retrieved from the PubChem database." assertion.
- Datasets.zul?datasetID=ds14 title "Skin Irritation potential of small molecules" assertion.
- Datasets.zul?datasetID=ds14 type Excel assertion.
- Datasets.zul?datasetID=ds14 identifier Datasets.zul?datasetID=ds14 assertion.
- Datasets.zul?datasetID=ds14 license 4.0 assertion.
- Datasets.zul?datasetID=ds14 publisher novamechanics.eu assertion.
- Datasets.zul?datasetID=ds14 hasVersion "1" assertion.
- Datasets.zul?datasetID=ds14 isHostedBy chempharos.html assertion.
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- Datasets.zul?datasetID=ds14 hasTarget RAVXKGINlP1wgG8wygwBViSnlDrs_wGzq07404GgM8ncY assertion.
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- Datasets.zul?datasetID=ds14 references EHP9341 assertion.