Exhaustive set of non-isomorphic sub-graphs and its application to chemical structure elucidation using a IR spectroscopy database von Piottukh-Peletsky, V.N., Korobeinicheva, I.K., Bogdanova, T.F., Molodtsov, S.G., Derendyaev, B.G.

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Structural similarity and modeling of infrared spectra of molecules of organic compounds von Zhbankov, R.G., Korolevich, M.V., Derendyaev, B.G., Piottukh-Peletsky, V.N.

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Estimating the degree of similarity overlap for structural data in spectral databases von Kornakova, T.A., Bogdanova, T.F., Derendyaev, B.G., Piottukh-Peletsky, V.N.

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Use of the mass spectrum-compound fragment composition database in the determination of the structure of organic compounds von DERENDYAEV, B. G, PIOTTUKH-PELETSKII, V. N, CHMUTINA, K. S, NEKHOROSHEV, S. A

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Fast taxonomy of chemical structures selected from IR spectral database von Derendyaev, B.G, Bogdanova, T.F, Piottukh-Peletsky, V.N, Makarov, L.I

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Evaluation of the relationship between spectral and structural similarity in IR spectroscopy von Piottukh-Peletskii, V. N., Derendyaev, B. G., Sharapova, O. N.

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Which IR search system is better for selection of unknown structure analogues? von Piottukh-Peletsky, V.N., Derendyaev, B.G.

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Interpretation of IR spectra using complete sets of structure fragment compositions and an IR search system. 3. Analysis of large fragments von Piottukh-Peletskii, V. N., Derendyaev, B. G., Bogdanova, T. F.

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Interpretation of IR spectra using complete sets of fragment compositions and an ir search system. 2. Determination of microfragment compositions of organic compounds von Piottukh-Peletskii, V. N., Derendyaev, B. G., Bogdanova, T. F.

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Complete sets of fragment compositions of structures for ir spectrum interpretation using a database. 4. Forming the most probable hypothesis about the structure of the unknown von Piottukh-Peletskii, V. N., Derendyaev, B. G., Molodtsov, S. G., Bogdanova, T. F.

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Recognition of Large Structural Fragments of Organic Compounds by Fast Clusterization of IR Search Result Structures von Derendyaev, B. G., Bogdanova, T. F., Makarov, L. I., Piottukh-Peletskii, V. N.

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Proof of structure similarity as a function of spectral similarity in IR spectral search von Derendyaev, B. G., Piottukh-Peletskii, V. N.

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Structural data representation and search for structural analogs in molecular spectroscopy databases von Strokov, I. I., Lebedev, K. S., Derendyaev, B. G.

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Applicability of a mass spectrum-fragment composition database to structure elucidation of compounds von Derendyaev, B. G., Piottukh-Peletskii, V. N., Nekhoroshev, S. A., Kirshanskii, S. P., Bogdanova, T. F., Makarov, L. I.

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Complete sets of structure fragments for interpreting IR spectra using IR databases von Piottukh-Peletskii, V. N., Bogdanova, T. F., Derendyaev, B. G.

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Data selection for structure generation in structure elucidation systems using molecular spectroscopy databases von Molodtsov, S. G., Lebedev, K. S., Derendyaev, B. G.

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Estimating the degree of similarity overlap for structural data in spectral databases von KORNAKOVA, T. A, BOGDANOVA, T. F, DERENDYAEV, B. G, PIOTTUKH-PELETSKY, V. N

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Fast taxonomy of chemical structures selected from IR spectral database von DERENDYAEV, B. G, BOGDANOVA, T. F, PIOTTUKH-PELETSKY, V. N, MAKAROV, L. I

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A computer search system for chemical structure elucidation based on low-resolution mass spectra von Lebedev, K.S., Tormyshev, V.M., Derendyaev, B.G., Koptyug, V.A.

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Which IR search system is better for selection of unknown structure analogues? von PIOTTUKH-PELETSKY, V. N, DERENDYAEV, B. G

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