Original scientific paper
A Dual of the Cycle Theorem and its Application to Molecular Complexity
Edward C. Kirby
; Resource Use Institute, Fishersview Court, Pitlochry PH16 5AN, Scotland, United Kingdom
Roger B. Mallion ; School of Physical Sciences, University of Kent, Canterbury CT2 7NH, England, United Kingdom
Paul Pollak ; The King’s School, Canterbury CT1 2ES, England, United Kingdom
Paweł J. Skrzyński ; The Canterbury High School, Canterbury CT2 8QA, England, United Kingdom
APA 6th Edition
Kirby, E.C., Mallion, R.B., Pollak, P. & Skrzyński, P.J. (2017). A Dual of the Cycle Theorem and its Application to Molecular Complexity. Croatica Chemica Acta, 90 (1), 75-85. https://doi.org/10.5562/cca3099
MLA 8th Edition
Kirby, Edward C., et al. "A Dual of the Cycle Theorem and its Application to Molecular Complexity." Croatica Chemica Acta, vol. 90, no. 1, 2017, pp. 75-85. https://doi.org/10.5562/cca3099. Accessed 10 Aug. 2022.
Chicago 17th Edition
Kirby, Edward C., Roger B. Mallion, Paul Pollak and Paweł J. Skrzyński. "A Dual of the Cycle Theorem and its Application to Molecular Complexity." Croatica Chemica Acta 90, no. 1 (2017): 75-85. https://doi.org/10.5562/cca3099
Kirby, E.C., et al. (2017). 'A Dual of the Cycle Theorem and its Application to Molecular Complexity', Croatica Chemica Acta, 90(1), pp. 75-85. https://doi.org/10.5562/cca3099
Kirby EC, Mallion RB, Pollak P, Skrzyński PJ. A Dual of the Cycle Theorem and its Application to Molecular Complexity. Croatica Chemica Acta [Internet]. 2017 [cited 2022 August 10];90(1):75-85. https://doi.org/10.5562/cca3099
E.C. Kirby, R.B. Mallion, P. Pollak and P.J. Skrzyński, "A Dual of the Cycle Theorem and its Application to Molecular Complexity", Croatica Chemica Acta, vol.90, no. 1, pp. 75-85, 2017. [Online]. https://doi.org/10.5562/cca3099
The duality alluded to in the title is that between the faces and vertices of a graph embedded on a surface. Its recognition in the context of the five Platonic solids is classic. Algebraically, it is present in the equation for Euler’s Polyhedron Theorem and in the various extensions thereof. The Cycle Theorem (CT) establishes a formula for the number of spanning trees contained in a graph embedded on a surface. It is based on the mutual incidences of its cycles (circuits which also carry a sense of direction), i.e., of sub-graphs of the Cn type, endorsed with a sense. These appear (though not exclusively) as the boundaries of faces, so that, so to speak, the Cycle Theorem establishes a result which is essentially about vertices via relations between faces. Among several possible duals of the Cycle Theorem there might thus be one that estab¬lishes a relation which is essentially about faces via relations between vertices. In order to formulate one, we define, for an embedded graph, a feature concerning faces that is dual to a spanning tree. We call it a ladder. A formula is presented for the number of ladders contained in a graph which, in some cases, introduces the concept of ‘artificial vertices’. It is based on the mutual incidences of its vertices. Its form is clearly analogous, or ‘dual’, to the Cycle Theorem formula for spanning trees, previously proposed (in this journal — 2004) by three of the present authors, together with Klein and Sachs. A new index is proposed, which involves ladders. We call it the Patency Index of a graph; its numerical value may be related to molecular complexity. It is effectively the dual of, and is entirely analogous to, the Spanning-Tree Density Index which was earlier (2003) proposed, defined and applied to molecular graphs by one of the present authors and Trinajstić.
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