Wikipedia Chemical Structure Explorer: substructure and similarity searching of molecules from Wikipedia

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Wikipedia Chemical Structure Explorer: substructure and similarity searching of molecules from Wikipedia

BACKGROUND Wikipedia, the world's largest and most popular encyclopedia is an indispensable source of chemistry information. It contains among others also entries for over 15,000 chemicals including metabolites, drugs, agrochemicals and industrial chemicals. To provide an easy access to this wealth of information we decided to develop a substructure and similarity search tool for chemical struc...

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ژورنال

عنوان ژورنال: Journal of Cheminformatics

سال: 2015

ISSN: 1758-2946

DOI: 10.1186/s13321-015-0061-y