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Maximum Symmetrical Split of Molecular Graphs. Application to Organic Synthesis Design
Journal article   Open access   Peer reviewed

Maximum Symmetrical Split of Molecular Graphs. Application to Organic Synthesis Design

Philippe Vismara, Claude Laurenço and Yannick Tognetti
Journal of Chemical Information and Modeling, Vol.45(3), pp.685-695
2005

Abstract

Whereas the potential symmetry of a molecule may be a feature of importance in synthesis design, this one is often difficult to detect visually in the structural formula. In the present article, we describe an efficient algorithm for the perception of this molecular property.
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