Substructure search

id: substructure-search-165-6426011
title: Substructure search
text: Substructure search (SSS) is a method to retrieve from a database only those chemicals matching a pattern of atoms and bonds which a user specifies. It is an application of graph theory, specifically subgraph matching in which the query is a hydrogen-depleted molecular graph. The mathematical foundations for the method were laid in the 1870s, when it was suggested that chemical structure drawings were equivalent to graphs with atoms as vertices and bonds as edges. SSS is now a standard part of c
brand slug: wiki
category slug: encyclopedia
description:
original url: https://en.wikipedia.org/wiki/Substructure_search
date created: 2006-06-20T20:40:35Z
date modified: 2024-08-29T12:58:40Z
main entity:
image: {"content_url":"https://upload.wikimedia.org/wikipedia/commons/1/11/Lenalidomide_substructures.svg","width":512,"height":289}
fields total: 13
integrity: 14

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