Title: AnalogExplorer Program

Type Software Zhang, Bijun, Hu, Ye, Bajorath, Jürgen (2014): AnalogExplorer Program. Zenodo. Software. https://zenodo.org/record/12349

Authors: Zhang, Bijun (Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Dahlmannstr. 2, D-53113 Bonn, Germany.) ; Hu, Ye (Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Dahlmannstr. 2, D-53113 Bonn, Germany.) ; Bajorath, Jürgen (Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Dahlmannstr. 2, D-53113 Bonn, Germany.) ;

Links

• Item record in Zenodo
• Digital object URL

Summary

The program of AnalogExplorer, i.e., a new method for graphical analysis of analog series and associated structure-activity relationship information, has been provided. The implementation of the program is detailed in the file 'HowToRunAnalogExplorer.txt'.

More information

• DOI: 10.5281/zenodo.12349

Subjects

• analog series, structural organization, structure-activity relationships, visualization, maximum common substructure, matched molecular pairs

Dates

• Publication date: 2014
• Issued: October 22, 2014

Rights

• info:eu-repo/semantics/closedAccess Closed Access

Format

electronic resource

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