Abstract
A simple manipulation of the Euclidian distance expression permits to obtain a scaled dissimilarity index measure, varying within a range of values lying in the interval [0,1]. Here is presented the theoretical background, its application to quantum similarity and use for artificial intelligence general purposes as well. The origin of Hodgkin-Richards index is analyzed and compared with quantum similarity Carbó index.
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References
Carbó R., Leyda L., Arnau M.: Int. J. Quantum Chem. 17, 1185 (1980)
Carbó R., Besalú E., Calabuig B., Vera L.: Adv. Quantum Chem. 25, 253 (1994)
R. Carbó, E. Besalú, Theoretical Foundation of Quantum Similarity in Molecular Similarity and Reactivity: From Quantum Chemical to Phenomenological Approaches, ed. by R. Carbó. Understanding Chemical Reactivity, vol 14 (Kluwer, Amsterdam, 1995), pp. 3–30
Carbó R., Besalú E., Amat L., Fradera X.: J. Math. Chem. 19, 47 (1996)
Hodgkin E.E., Richards W.G.: Int. J. Quantum Chem. S 14, 105 (1987)
Carbó-Dorca R.: J. Mol. Struct. Teochem 537, 41 (2001)
Carbó-Dorca R.: J. Math. Chem. 32, 201 (2002)
Bultinck P., Carbó-Dorca R.: J. Math. Chem. 36, 191 (2004)
P. Bultinck, X. Girones, and R. Carbó-Dorca, in Molecular Quantum Similarity: Theory and Applications, ed. by K.B. Lipkowitz, R. Larter, T. Cundari. Reviews in Computational Chemistry, vol 21 (Wiley, Hoboken, 2005), pp. 127–207
Carbó-Dorca R.: J. Math. Chem. 44, 628 (2008)
Carbó-Dorca R.: J. Math. Chem. 47, 331 (2010)
Ayers Paul W., Carbó-Dorca R.: J. Math. Chem. 49, 6 (2011)
Mercado L.D., Carbó-Dorca R.: Quantum similarity and discrete representation of Molecular sets. J. Math. Chem. 49, 1558–1572 (2011)
Carbó-Dorca R.: Quantum similarity, Volume Functions and Generalized Carbó Indices. J. Math. Chem. 49, 2109–2115 (2011)
R. Carbó-Dorca, E. Besalú, Shells, point cloud huts, generalized scalar products, cosines and similarity tensor representations in vector semispaces. J. Math. Chem. (2011). doi:10.1007/s10910-011-9906-4
Bultinck P., Carbó-Dorca R.: J. Chem. Inf. Comp. Sci. 43, 170 (2003)
Sneath P.H.A., Sokal R.R.: Numerical Taxonomy. W. H. Freeman & Co., San Francisco (1973)
Deza M.M., Deza E.: Encyclopedia of Distances. Springer, Berlin (2009)
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Carbó-Dorca, R. Scaled Euclidian distances: a general dissimilarity index with a suitably defined geometrical foundation. J Math Chem 50, 734–740 (2012). https://doi.org/10.1007/s10910-011-9920-6
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DOI: https://doi.org/10.1007/s10910-011-9920-6