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1.
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http://dx.doi.org/10.1016/S0003-2670(97)00238-9
Computer-assisted IR spectra prediction — linked similarity searches for structures and spectra
Analytica Chimica Acta, Volume 348, Issues 1-3, 20 August 1997, Pages 327-343
K. Baumann and J. T. Clerc
2.
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http://dx.doi.org/10.1016/S0165-9936(98)00075-2
Uniform-length molecular descriptors for quantitative structure–property relationships (QSPR) and quantitative structure–activity relationships (QSAR): classification studies and similarity searching
TrAC Trends in Analytical Chemistry, Volume 18, Issue 1, January 1999, Pages 36-46
Knut Baumann
3.
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http://dx.doi.org/10.1016/S0169-7439(01)00142-3
Comparison of spectrum-like representation of 3D chemical structure with other representations when used for modelling biological activity
Chemometrics and Intelligent Laboratory Systems, Volume 59, Issues 1-2, 28 November 2001, Pages 33-44
Marjana Novi and Marjan Vrako
4.
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http://dx.doi.org/10.1016/0166-1280(85)85100-9
Graph theory and theoretical chemistry
Journal of Molecular Structure: THEOCHEM, Volume 120, February 1985, Pages 117-142
Alexandru T. Balaban
5.
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http://dx.doi.org/10.1016/0166-1280(88)87023-4
Topological indices and their uses: A new approach for the coding of alkanes
Journal of Molecular Structure: THEOCHEM, Volume 165, Issues 3-4, May 1988, Pages 243-253
Alexandru T. Balaban
6.
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http://dx.doi.org/10.1016/0166-1280(93)80012-O
Topological/chemical distances and graph centers in molecular graphs with multiple bonds
Journal of Molecular Structure: THEOCHEM, Volume 280, Issues 2-3, 6 April 1993, Pages 253-260
Alexandry T. Balaban, Danail Bonchev and William A. Scitz
7.
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http://dx.doi.org/10.1016/S0166-1280(96)04746-X
Reaction graphs for rearrangements of pentagonal-bipyramidal complexes
Journal of Molecular Structure: THEOCHEM, Volume 389, Issue 3, 31 January 1997, Pages 265-277
Alexandru T. Balaban, Tomislav P. Zivkovic, Douglas J. Klein and Thomas G. Schmalz
8.
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http://dx.doi.org/10.1016/S0166-1280(00)00578-9
A topological approach to predicting properties of infinite polymers. Part VI. Rational formulas for the normalized Wiener index and a comparison with index J
Journal of Molecular Structure: THEOCHEM, Volume 535, Issues 1-3, 15 January 2001, Pages 81-92
T. -S. Balaban, A. T. Balaban and D. Bonchev
9.
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http://dx.doi.org/10.1016/0898-1221(86)90437-2
Symmetry in chemical structures and reactions
Computers & Mathematics with Applications, Volume 12, Issues 3-4, Part 2, May-August 1986, Pages 999-1020
Alexandru T. Balaban
10.
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http://dx.doi.org/10.1016/0166-218X(88)90003-0
Alternating 6-cycles in perfect matchings of graphs representing condensed benzenoid hydrocarbons
Discrete Applied Mathematics, Volume 19, Issues 1-3, March 1988, Pages 5-16
Balaban Alexandru T.Ioan Tomescu
11.
From Molecular Connectivity Indices to Semiempirical Connectivity Terms: Recent Trends in Graph Theoretical Descriptors
Pogliani, L.
Chem. Rev.; (Review); 2000; 100(10); 3827-3858.
Заранее благодарен.
