Transparency in Modeling through Careful Application of OECD’s QSAR/QSPR Principles via a Curated Water Solubility Data Set

Description

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), 465-478
DOI: 10.1021/acs.chemrestox.2c00379".

This dataset is associated with the following publication:
Lowe, C., N. Charest, C. Ramsland, D. Chang, T. Martin, and A. Williams. Transparency in Modeling through Careful Application of OECD’s QSAR/QSPR Principles via a Curated Water Solubility Data Set. CHEMICAL RESEARCH IN TOXICOLOGY. American Chemical Society, Washington, DC, USA, 36(3): 465-478, (2023).

Resources

Name Format Description Link
Figures S1.pdf PDF Figures%20S1.pdf Open resource
QMRF for Water Solubility Model.pdf PDF QMRF%20for%20Water%20Solubility%20Model.pdf Open resource
Tables S1-S4.xlsx XLS Tables%20S1-S4.xlsx Open resource

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