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Wikipedia Chemical Structure Explorer: substructure and similarity searching of molecules from Wikipedia.
Peter Ertl
Luc Patiny
Thomas Sander
Christian Rufener
Michaël Zasso
Published in:
J. Cheminformatics (2015)
Keyphrases
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similarity searching
virtual screening
chemical structures
molecular structures
similarity search
search engine
digital libraries
drug discovery
databases
neural network
chemical compounds
information retrieval
multimedia
information extraction
chemical reactions