Skip to main content
U.S. flag

An official website of the United States government

Official websites use .gov
A .gov website belongs to an official government organization in the United States.

Secure .gov websites use HTTPS
A lock ( ) or https:// means you’ve safely connected to the .gov website. Share sensitive information only on official, secure websites.

Skip to content

Evaluation of quantitative structure property relationship algorithms for predicting plasma protein binding in humans-UW-QSPR-Supplementary data

Metadata Updated: March 9, 2021

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. Purucker, D. Chang, and A.N. Edginton. Evaluation of Quantitative Structure Property Relationship algorithms for predicting plasma protein binding in humans. Computational Toxicology. Elsevier B.V., Amsterdam, NETHERLANDS, 17: 100142, (2021).

Access & Use Information

Public: This dataset is intended for public access and use. License: See this page for license information.

Downloads & Resources

References

https://doi.org/10.1016/j.comtox.2020.100142

Dates

Metadata Created Date March 9, 2021
Metadata Updated Date March 9, 2021

Metadata Source

Harvested from EPA ScienceHub

Additional Metadata

Resource Type Dataset
Metadata Created Date March 9, 2021
Metadata Updated Date March 9, 2021
Publisher U.S. EPA Office of Research and Development (ORD)
Maintainer
Identifier https://doi.org/10.23719/1520781
Data Last Modified 2020-04-27
Public Access Level public
Bureau Code 020:00
Schema Version https://project-open-data.cio.gov/v1.1/schema
Harvest Object Id 59e78fb1-2759-43e9-8103-baf63e619c4c
Harvest Source Id 04b59eaf-ae53-4066-93db-80f2ed0df446
Harvest Source Title EPA ScienceHub
License https://pasteur.epa.gov/license/sciencehub-license.html
Program Code 020:095
Publisher Hierarchy U.S. Government > U.S. Environmental Protection Agency > U.S. EPA Office of Research and Development (ORD)
Related Documents https://doi.org/10.1016/j.comtox.2020.100142
Source Datajson Identifier True
Source Hash 8d2f2796cfd546f00eec32b6f7ac1afc46370ddb
Source Schema Version 1.1

Didn't find what you're looking for? Suggest a dataset here.