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Naive Substructure Substance Matching on the Raspberry Pi

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Matt Williams

Posts: 466
Nickname: aetherical
Registered: Feb, 2008

Matt Williams is a jack-of-all trades living in Columbus, OH.
Naive Substructure Substance Matching on the Raspberry Pi Posted: Apr 18, 2015 9:41 PM
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Chemists can search databases using parts of structures, parts of their IUPAC names as well as based on constraints on properties. Chemical databases are particularly different from other general purpose databases in their support for sub-structure search. This kind of search is achieved by looking for subgraph isomorphism (sometimes also called a monomorphism) and is …

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