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Found 3 datasets matching "QSPR".

Federal
Transparency in Modeling through Careful Application of OECD’s QSAR/QSPR Principles via a Curated Water Solubility Data Set
- Organization: U.S. Environmental Protection Agency
- Updated: 2023-03-06
Figures, Tables, and QRMF for "Charles N. Lowe, Nathaniel Charest, Christian Ramsland, Daniel T. Chang, Todd M. Martin, and Antony J. Williams Chemical Research in Toxicology 2023 36 (3),...
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Search relevance: 90.15 | Views last month: 0
Federal
Evaluation of quantitative structure property relationship algorithms for predicting plasma protein binding in humans-UW-QSPR-Supplementary data
- Organization: U.S. Environmental Protection Agency
- Updated: 2020-04-27
Observed fup data obtained from the literature; SMILES structures obtained from Pubchem SDF files. This dataset is associated with the following publication: Yun, Y.E., R. Tornero-Velez, T....
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Search relevance: 82.22 | Views last month: 0
Federal
Impact of gut permeability on estimation of oral bioavailability for chemicals in commerce and the environment
- Organization: U.S. Environmental Protection Agency
- Updated: 2024-10-19
Supplementary files for "Impact of gut permeability on estimation of oral bioavailability for chemicals in commerce and the environment"
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Search relevance: 30.93 | Views last month: 0

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