Molecules in silico: potential versus known organic compounds

MaRDI QIDQ3369102zbMATH OpenFDO

Authors Adalbert Kerber, Reinhard Laue, Markus Meringer, Christoph Rücker

Publication date 13 February 2006

zbMATH Keywords

generation of molecular formulastructural formula (in chemistry)

Mathematics Subject Classification ID

Applications of graph theory (05C90) Chemistry (92E99) Enumeration in graph theory (05C30) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

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Uses Software

• MOLGEN

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