I. V. Kochikov, G. M. Kuramshina, L. M. Samkov, D. A. Sharapov, S. A. Sharapova, “Identification algorithms for substances in the hybrid database on molecular spectral constants (ISMOL)”, Num. Meth. Prog., 2007, Volume 8, Issue 4,Pages <nobr>70

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Программирование

Identification algorithms for substances in the hybrid database on molecular spectral constants (ISMOL)

I. V. Kochikov^a, G. M. Kuramshina^b, L. M. Samkov^c, D. A. Sharapov^d, S. A. Sharapova^d

^a Lomonosov Moscow State University, Research Computing Center
^b Lomonosov Moscow State University, Faculty of Chemistry
^c Ugra Research Institute of Information Technologies
^d Lomonosov Moscow State University, Faculty of Physics

Abstract: This paper presents the description of identification algorithms for substances used in the information system ISMOL - a hybrid database on molecular constants of organic compounds existing in raw oil and its refinement products.

Keywords: identification of chemical substances, spectral constants, information systems, databases, molecular compounds.

UDC: 532.6