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Mati Karelson

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2007
33EECsaba Hetényi, Uko Maran, Alfonso T. García-Sosa, Mati Karelson: Structure-based calculation of drug efficiency indices. Bioinformatics 23(20): 2678-2685 (2007)
2006
32EESulev Sild, Uko Maran, Andre Lomaka, Mati Karelson: Open Computing Grid for Molecular Science and Engineering. Journal of Chemical Information and Modeling 46(3): 953-959 (2006)
2005
31EEIiris Kahn, Dan C. Fara, Mati Karelson, Uko Maran, Patrik L. Andersson: QSPR Treatment of the Soil Sorption Coefficients of Organic Pollutants. Journal of Chemical Information and Modeling 45(1): 94-105 (2005)
30EEAlan R. Katritzky, Ritu Jain, Andre Lomaka, Ruslan Petrukhin, Mati Karelson, Ann E. Visser, Robin D. Rogers: Correlation of the Melting Points of Potential Ionic Liquids (Imidazolium Bromides and Benzimidazolium Bromides) Using the CODESSA Program [J. Chem. Inf. Comput. Sci. 42, 225-231 (2002)]. Journal of Chemical Information and Modeling 45(2): 533-534 (2005)
2004
29 Paolo Mazzatorta, Emilio Benfenati, Bernd Schuller, Mathilde Romberg, Damian McCourt, Werner Dubitzky, Sulev Sild, Mati Karelson, Ákos Papp, István Bágyi, Ferenc Darvas: OpenMolGRIND: Molecular Science and Engineering in a Grid Context. PDPTA 2004: 775-779
28EEAlan R. Katritzky, Dan C. Fara, Hongfang Yang, Mati Karelson, Takahiro Suzuki, Vitaly P. Solov'ev, Alexandre Varnek: Quantitative Structure-Property Relationship Modeling of beta-Cyclodextrin Complexation Free Energies. Journal of Chemical Information and Modeling 44(2): 529-541 (2004)
2003
27EECsaba Hetényi, Uko Maran, Mati Karelson: A Comprehensive Docking Study on the Selectivity of Binding of Aromatic Compounds to Proteins. Journal of Chemical Information and Computer Sciences 43(5): 1576-1583 (2003)
2002
26EERein Hiob, Mati Karelson: QSPR Models Derived for the Kinetic Data of the Gas-phase Homolysis of the Carbon-methyl Bond. Computers & Chemistry 26(3): 237-243 (2002)
25EEKatrin Sak, Jaak Järv, Mati Karelson: `Strain Effect' Descriptors for ATP and ADP Derivatives with Modified Phosphate Groups. Computers & Chemistry 26(4): 341-346 (2002)
24EEAlan R. Katritzky, Andre Lomaka, Ruslan Petrukhin, Ritu Jain, Mati Karelson, Ann E. Visser, Robin D. Rogers: QSPR Correlation of the Melting Point for Pyridinium Bromides, Potential Ionic Liquids. Journal of Chemical Information and Computer Sciences 42(1): 71-74 (2002)
23EEAlan R. Katritzky, Ritu Jain, Andre Lomaka, Ruslan Petrukhin, Mati Karelson, Ann E. Visser, Robin D. Rogers: Correlation of the Melting Points of Potential Ionic Liquids (Imidazolium Bromides and Benzimidazolium Bromides) Using the CODESSA Program. Journal of Chemical Information and Computer Sciences 42(2): 225-231 (2002)
22EESulev Sild, Mati Karelson: A General QSPR Treatment for Dielectric Constants of Organic Compounds. Journal of Chemical Information and Computer Sciences 42(2): 360-367 (2002)
21EEWilliam L. Fitch, Malcolm McGregor, Alan R. Katritzky, Andre Lomaka, Ruslan Petrukhin, Mati Karelson: Prediction of Ultraviolet Spectral Absorbance Using Quantitative Structure-Property Relationships. Journal of Chemical Information and Computer Sciences 42(4): 830-840 (2002)
20EEPatrik L. Andersson, Uko Maran, Dan C. Fara, Mati Karelson, Joop L. M. Hermens: General and Class Specific Models for Prediction of Soil Sorption Using Various Physicochemical Descriptors. Journal of Chemical Information and Computer Sciences 42(6): 1450-1459 (2002)
2001
19EEJaan Leis, Mati Karelson: A QSPR Model for the Prediction of the Gas-phase Free Energies of Activation of Rotation Around the N---C(O) Bond. Computers & Chemistry 25(2): 171-176 (2001)
18EEFrederick Ignatz-Hoover, Ruslan Petrukhin, Mati Karelson, Alan R. Katritzky: QSRR Correlation of Free-Radical Polymerization Chain-Transfer Constants for Styrene. Journal of Chemical Information and Computer Sciences 41(2): 295-299 (2001)
17EEAlan R. Katritzky, Ruslan Petrukhin, Douglas B. Tatham, Subhash C. Basak, Emilio Benfenati, Mati Karelson, Uko Maran: Interpretation of Quantitative Structure-Property and -Activity Relationships. Journal of Chemical Information and Computer Sciences 41(3): 679-685 (2001)
16EEAlan R. Katritzky, Ruslan Petrukhin, Ritu Jain, Mati Karelson: QSPR Analysis of Flash Points. Journal of Chemical Information and Computer Sciences 41(6): 1521-1530 (2001)
2000
15EERein Hiob, Mati Karelson: Quantitative Relationship between Rate Constants of the Gas-Phase Homolysis of C-X Bonds and Molecular Descriptors. Journal of Chemical Information and Computer Sciences 40(4): 1062-1071 (2000)
1999
14EEMati Karelson, Anti Perkson: QSPR Prediction of Densities of Organic Liquids. Computers & Chemistry 23(1): 49-59 (1999)
13EEBono Lui, Nenad Trinajstic, Sulev Sild, Mati Karelson, Alan R. Katritzky: A New Efficient Approach for Variable Selection Based on Multiregression: Prediction of Gas Chromatographic Retention Times and Response Factors. Journal of Chemical Information and Computer Sciences 39(3): 610-621 (1999)
12EEAlan R. Katritzky, Tarmo Tamm, Yilin Wang, Sulev Sild, Mati Karelson: QSPR Treatment of Solvent Scales. Journal of Chemical Information and Computer Sciences 39(4): 684-691 (1999)
11EEAlan R. Katritzky, Tarmo Tamm, Yilin Wang, Mati Karelson: A Unified Treatment of Solvent Properties. Journal of Chemical Information and Computer Sciences 39(4): 692-698 (1999)
1998
10EEAlan R. Katritzky, Victor S. Lobanov, Mati Karelson: Normal Boiling Points for Organic Compounds: Correlation and Prediction by a Quantitative Structure-Property Relationship. Journal of Chemical Information and Computer Sciences 38(1): 28-41 (1998)
9EEAlan R. Katritzky, Lan Mu, Mati Karelson: Relationships of Critical Temperatures to Calculated Molecular Properties. Journal of Chemical Information and Computer Sciences 38(2): 293-299 (1998)
8EEAlan R. Katritzky, Sulev Sild, Victor S. Lobanov, Mati Karelson: Quantitative Structure-Property Relationship (QSPR) Correlation of Glass Transition Temperatures of High Molecular Weight Polymers. Journal of Chemical Information and Computer Sciences 38(2): 300-304 (1998)
7EEAlan R. Katritzky, Yilin Wang, Sulev Sild, Tarmo Tamm, Mati Karelson: QSPR Studies on Vapor Pressure, Aqueous Solubility, and the Prediction of Water-Air Partition Coefficients. Journal of Chemical Information and Computer Sciences 38(4): 720-725 (1998)
6EEAlan R. Katritzky, Sulev Sild, Mati Karelson: General Quantitative Structure-Property Relationship Treatment of the Refractive Index of Organic Compounds. Journal of Chemical Information and Computer Sciences 38(5): 840-844 (1998)
5EEAlan R. Katritzky, Sulev Sild, Mati Karelson: Correlation and Prediction of the Refractive Indices of Polymers by QSPR. Journal of Chemical Information and Computer Sciences 38(6): 1171-1176 (1998)
1997
4EEAlan R. Katritzky, Lan Mu, Mati Karelson: QSPR Treatment of the Unified Nonspecific Solvent Polarity Scale. Journal of Chemical Information and Computer Sciences 37(4): 756-761 (1997)
3EEAlan R. Katritzky, Uko Maran, Mati Karelson, Victor S. Lobanov: Prediction of Melting Points for the Substituted Benzenes: A QSPR Approach. Journal of Chemical Information and Computer Sciences 37(5): 913-919 (1997)
1996
2EEAlan R. Katritzky, Peter Rachwal, Kam Wah Law, Mati Karelson, Victor S. Lobanov: Prediction of Polymer Glass Transition Temperatures Using a General Quantitative Structure-Property Relationship Treatment. Journal of Chemical Information and Computer Sciences 36(4): 879-884 (1996)
1EEAlan R. Katritzky, Lan Mu, Mati Karelson: A QSPR Study of the Solubility of Gases and Vapors in Water. Journal of Chemical Information and Computer Sciences 36(6): 1162-1168 (1996)

Coauthor Index

1Patrik L. Andersson [20] [31]
2István Bágyi [29]
3Subhash C. Basak [17]
4Emilio Benfenati [17] [29]
5Ferenc Darvas [29]
6Werner Dubitzky [29]
7Dan C. Fara [20] [28] [31]
8William L. Fitch [21]
9Alfonso T. García-Sosa [33]
10Joop L. M. Hermens [20]
11Csaba Hetényi [27] [33]
12Rein Hiob [15] [26]
13Frederick Ignatz-Hoover [18]
14Ritu Jain [16] [23] [24] [30]
15Jaak Järv [25]
16Iiris Kahn [31]
17Alan R. Katritzky [1] [2] [3] [4] [5] [6] [7] [8] [9] [10] [11] [12] [13] [16] [17] [18] [21] [23] [24] [28] [30]
18Kam Wah Law [2]
19Jaan Leis [19]
20Victor S. Lobanov [2] [3] [8] [10]
21Andre Lomaka [21] [23] [24] [30] [32]
22Bono Lui [13]
23Uko Maran [3] [17] [20] [27] [31] [32] [33]
24Paolo Mazzatorta [29]
25Damian McCourt [29]
26Malcolm McGregor [21]
27Lan Mu [1] [4] [9]
28Ákos Papp [29]
29Anti Perkson [14]
30Ruslan Petrukhin [16] [17] [18] [21] [23] [24] [30]
31Peter Rachwal [2]
32Robin D. Rogers [23] [24] [30]
33Mathilde Romberg [29]
34Katrin Sak [25]
35Bernd Schuller [29]
36Sulev Sild [5] [6] [7] [8] [12] [13] [22] [29] [32]
37Vitaly P. Solov'ev [28]
38Takahiro Suzuki [28]
39Tarmo Tamm [7] [11] [12]
40Douglas B. Tatham [17]
41Nenad Trinajstic [13]
42Alexandre Varnek [28]
43Ann E. Visser [23] [24] [30]
44Yilin Wang [7] [11] [12]
45Hongfang Yang [28]

Colors in the list of coauthors

Copyright © Sun May 17 03:24:02 2009 by Michael Ley (ley@uni-trier.de)