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Mati Karelson
Mati Karelson
Professor of Molecular Technology, University of Tartu
Email verificata su ut.ee
Titolo
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Anno
Quantum-chemical descriptors in QSAR/QSPR studies
M Karelson, VS Lobanov, AR Katritzky
Chemical reviews 96 (3), 1027-1044, 1996
21521996
Molecular Descriptors in QSAR/QSPR
M Karelson
Wiley-Interscience, 2000
10342000
QSPR: the correlation and quantitative prediction of chemical and physical properties from structure
AR Katritzky, VS Lobanov, M Karelson
Chemical Society Reviews 24 (4), 279-287, 1995
6591995
Quantitative correlation of physical and chemical properties with chemical structure: utility for prediction
AR Katritzky, M Kuanar, S Slavov, CD Hall, M Karelson, I Kahn, ...
Chemical reviews 110 (10), 5714-5789, 2010
6522010
Quantitative measures of solvent polarity
AR Katritzky, DC Fara, H Yang, K Tämm, T Tamm, M Karelson
Chemical reviews 104 (1), 175-198, 2004
4902004
Theoretical treatment of solvent effects on electronic spectroscopy
MM Karelson, MC Zerner
The Journal of Physical Chemistry 96 (17), 6949-6957, 1992
3731992
Prediction of critical micelle concentration using a quantitative structure− property relationship approach. 1. Nonionic surfactants
PDT Huibers, VS Lobanov, AR Katritzky, DO Shah, M Karelson
Langmuir 12 (6), 1462-1470, 1996
350*1996
Structurally diverse quantitative structure− property relationship correlations of technologically relevant physical properties
AR Katritzky, U Maran, VS Lobanov, M Karelson
Journal of chemical information and computer sciences 40 (1), 1-18, 2000
3472000
Aromaticity as a quantitative concept. 7. Aromaticity reaffirmed as a multidimensional characteristic
AR Katritzky, M Karelson, S Sild, TM Krygowski, K Jug
The Journal of Organic Chemistry 63 (15), 5228-5231, 1998
3441998
Correlation of boiling points with molecular structure. 1. A training set of 298 diverse organics and a test set of 9 simple inorganics
AR Katritzky, L Mu, VS Lobanov, M Karelson
The Journal of Physical Chemistry 100 (24), 10400-10407, 1996
3241996
Correlation of the melting points of potential ionic liquids (imidazolium bromides and benzimidazolium bromides) using the CODESSA program
AR Katritzky, R Jain, A Lomaka, R Petrukhin, M Karelson, AE Visser, ...
Journal of chemical information and computer sciences 42 (2), 225-231, 2002
2742002
QSPR correlation of the melting point for pyridinium bromides, potential ionic liquids
AR Katritzky, A Lomaka, R Petrukhin, R Jain, M Karelson, AE Visser, ...
Journal of chemical information and computer sciences 42 (1), 71-74, 2002
2452002
Prediction of gas chromatographic retention times and response factors using a general qualitative structure-property relationships treatment
AR Katritzky, ES Ignatchenko, RA Barcock, VS Lobanov, M Karelson
Analytical Chemistry 66 (11), 1799-1807, 1994
2401994
Perspective on the relationship between melting points and chemical structure
AR Katritzky, R Jain, A Lomaka, R Petrukhin, U Maran, M Karelson
Crystal Growth & Design 1 (4), 261-265, 2001
2372001
QSPR studies on vapor pressure, aqueous solubility, and the prediction of water− air partition coefficients
AR Katritzky, Y Wang, S Sild, T Tamm, M Karelson
Journal of Chemical Information and Computer Sciences 38 (4), 720-725, 1998
2151998
CODESSA: reference manual
AR Katritzky, VS Lobanov, M Karelson
University of Florida, Gainesville, FL, 1994
2071994
QSPR analysis of flash points
AR Katritzky, R Petrukhin, R Jain, M Karelson
Journal of chemical information and computer sciences 41 (6), 1521-1530, 2001
2002001
Correlation and Prediction of the Refractive Indices of Polymers by QSPR
AR Katritzky, S Sild, M Karelson
Journal of chemical information and computer sciences 38 (6), 1171-1176, 1998
1941998
CODESSA Comprehensive Descriptors for Structural and Statistical Analysis
AR Katritzky, VS Lobanov, M Karelson
Reference manual, 1994
1881994
Quantitative structure− property relationship (QSPR) correlation of glass transition temperatures of high molecular weight polymers
AR Katritzky, S Sild, V Lobanov, M Karelson
Journal of chemical information and computer sciences 38 (2), 300-304, 1998
1721998
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Articoli 1–20