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Results:
1-19
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Results: 19
Authors:
Leis, J
Karelson, M
Citation: J. Leis et M. Karelson, A QSPR model for the prediction of the gas-phase free energies of activation of rotation around the N-C(O) bond, COMPUT CHEM, 25(2), 2001, pp. 171-176
Authors:
Katritzky, AR
Petrukhin, R
Jain, R
Karelson, M
Citation: Ar. Katritzky et al., QSPR analysis of flash points, J CHEM INF, 41(6), 2001, pp. 1521-1530
Authors:
Katritzky, AR
Petrukhin, R
Tatham, D
Basak, S
Benfenati, E
Karelson, M
Maran, U
Citation: Ar. Katritzky et al., Interpretation of quantitative structure-property and -activity relationships, J CHEM INF, 41(3), 2001, pp. 679-685
Authors:
Ignatz-Hoover, F
Petrukhin, R
Karelson, M
Katritzky, AR
Citation: F. Ignatz-hoover et al., QSRR correlation of free-radical polymerization chain-transfer constants for styrene, J CHEM INF, 41(2), 2001, pp. 295-299
Authors:
Lomaka, A
Karelson, M
Citation: A. Lomaka et M. Karelson, A pivot algorithm for generating lowest energy structures of peptides, CHEM P LETT, 346(3-4), 2001, pp. 322-328
Authors:
Katritzky, AR
Chen, K
Wang, YL
Karelson, M
Lucic, B
Trinajstic, N
Suzuki, T
Schuurmann, G
Citation: Ar. Katritzky et al., Prediction of liquid viscosity for organic compounds by a quantitative structure-property relationship, J PHYS ORG, 13(1), 2000, pp. 80-86
Authors:
Karelson, M
Sild, S
Maran, U
Citation: M. Karelson et al., Non-linear QSAR treatment of genotoxicity, MOL SIMULAT, 24(4-6), 2000, pp. 229-242
Authors:
Hiob, R
Karelson, M
Citation: R. Hiob et M. Karelson, Quantitative relationship between rate constants of the gas-phase homolysis of C-X bonds and molecular descriptors, J CHEM INF, 40(4), 2000, pp. 1062-1071
Authors:
Katritzky, AR
Maran, U
Lobanov, VS
Karelson, M
Citation: Ar. Katritzky et al., Structurally diverse quantitative structure-property relationship correlations of technologically relevant physical properties, J CHEM INF, 40(1), 2000, pp. 1-18
Authors:
Yamamoto, S
Diercksen, GHF
Karelson, M
Citation: S. Yamamoto et al., An ab initio CI study of electronic spectra of substituted free-base porphyrins, CHEM P LETT, 318(6), 2000, pp. 590-596
Authors:
Menziani, MC
Montorsi, M
De Benedetti, PG
Karelson, M
Citation: Mc. Menziani et al., Relevance of theoretical molecular descriptors in quantitative structure-activity relationship analysis of alpha 1-adrenergic receptor antagonists, BIO MED CH, 7(11), 1999, pp. 2437-2451
Authors:
Maran, U
Karelson, M
Katritzky, AR
Citation: U. Maran et al., A comprehensive QSAR treatment of the genotoxicity of heteroaromatic and aromatic amines, QSAR, 18(1), 1999, pp. 3-10
Authors:
Karelson, M
Perkson, A
Citation: M. Karelson et A. Perkson, QSPR prediction of densities of organic liquids, COMPUT CHEM, 23(1), 1999, pp. 49-59
Authors:
Katritzky, AR
Tamm, T
Wang, YL
Sild, S
Karelson, M
Citation: Ar. Katritzky et al., QSPR treatment of solvent scales, J CHEM INF, 39(4), 1999, pp. 684-691
Authors:
Katritzky, AR
Tamm, T
Wang, YL
Karelson, M
Citation: Ar. Katritzky et al., A unified treatment of solvent properties, J CHEM INF, 39(4), 1999, pp. 692-698
Authors:
Sak, K
Karelson, M
Jarv, J
Citation: K. Sak et al., Modeling of the amino acid side chain effects on peptide conformation, BIOORG CHEM, 27(6), 1999, pp. 434-442
Authors:
Leis, J
Klika, KD
Pihlaja, K
Karelson, M
Citation: J. Leis et al., Dynamic processes in N-acylated 1,2-dihydro-2,2,4-trimethylbenzo(h)quinoline: A comparative study by NMR spectroscopy and quantum chemistry, TETRAHEDRON, 55(16), 1999, pp. 5227-5238
Authors:
Ignatz-Hoover, F
Katritzky, AR
Lobanov, VS
Karelson, M
Citation: F. Ignatz-hoover et al., Insights into sulfur vulcanization from QSPR quantitative structure-property relationships studies, RUBBER CHEM, 72(2), 1999, pp. 318-333
Authors:
Karelson, M
Maran, U
Wang, YL
Katritzky, AR
Citation: M. Karelson et al., QSPR and QSAR models derived using large molecular descriptor spaces. A review of CODESSA applications, COLL CZECH, 64(10), 1999, pp. 1551-1571
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