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AnalogExplorer Program

Zhang, Bijun; Hu, Ye; Bajorath, Jürgen

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'.

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Publication date:
October 22, 2014
DOI:
10.5281/zenodo.12349

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10.5281/zenodo.12349

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Keyword(s):
analog series structural organization structure-activity relationships visualization maximum common substructure matched molecular pairs
Published in:
Journal of Medicinal Chemistry: 57 (2014) pp. 9187-9194.
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Cites:
10.1021/jm501391g
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