Theoretical treatment of solvent effects on electronic spectroscopy von Karelson, Mati M, Zerner, Michael C

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Reconsideration of solvent effects calculated by semiempirical quantum chemical methods von Szafran, Miroslaw, Karelson, Mati M., Katritzky, Alan R., Koput, Jacek, Zerner, Michael C.

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A quantitative assessment of the merostabilization energy of carbon-centered radicals von Katritzky, Alan R, Zerner, Michael C, Karelson, Mati M

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Quantitative predictions of tautomeric equilibria for 2-, 3-, and 4-substituted pyridines in both the gas phase and aqueous solution: combination of AM1 with reaction field theory von Karelson, Mati M, Katritzky, Alan R, Szafran, Miroslaw, Zerner, Michael C

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Reaction field effects on the electron distribution and chemical reactivity of molecules von Karelson, Mati M., Katritzky, Alan R., Zerner, Michael C.

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A theoretical treatment of solvent effects on the tautomeric equilibria of five-membered rings with two heteroatoms von KARELSON, M. M, KATRITZKY, A. R, SZAFRAN, M, ZERNER, M. C

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Geometry optimisation at the semiempirical self-consistent-reaction-field level using the AMPAC and MOPAC programs von RZEPA, H. S, MANYIN YI, KARELSON, M. M, ZERNER, M. C

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M. O. calculations applicable to condensed phases: The combination of self-consistent reaction field theory with semi-empirical quantum-chemical methods von Karelson, Mati M., Tamm, Thomas, Katritzky, Alan R., Cato, Stephen J., Zerner, Michael C.

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A Novel Small Molecule GDNF Receptor RET Agonist, BT13, Promotes Neurite Growth from Sensory Neurons in Vitro and Attenuates Experimental Neuropathy in the Rat von Sidorova, Yulia A, Bespalov, Maxim M, Wong, Agnes W, Kambur, Oleg, Jokinen, Viljami, Lilius, Tuomas O, Suleymanova, Ilida, Karelson, Gunnar, Rauhala, Pekka V, Karelson, Mati, Osborne, Peregrine B, Keast, Janet R, Kalso, Eija A, Saarma, Mart

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Glial cell line–derived neurotrophic factor receptor Rearranged during transfection agonist supports dopamine neurons in Vitro and enhances dopamine release In Vivo von Mahato, Arun Kumar, Kopra, Jaakko, Renko, Juho‐Matti, Visnapuu, Tanel, Korhonen, Ilari, Pulkkinen, Nita, Bespalov, Maxim M., Domanskyi, Andrii, Ronken, Eric, Piepponen, T. Petteri, Voutilainen, Merja H., Tuominen, Raimo K., Karelson, Mati, Sidorova, Yulia A., Saarma, Mart

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Quantitative Measures of Solvent Polarity von Katritzky, Alan R, Fara, Dan C, Yang, Hongfang, Tämm, Kaido, Tamm, Tarmo, Karelson, Mati

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The proposal of architecture for chemical splitting to optimize QSAR models for aquatic toxicity von Colombo, Andrea, Benfenati, Emilio, Karelson, Mati, Maran, Uko

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Perspective on the Relationship between Melting Points and Chemical Structure von Katritzky, Alan R, Jain, Ritu, Lomaka, Andre, Petrukhin, Ruslan, Maran, Uko, Karelson, Mati

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QSPR: the correlation and quantitative prediction of chemical and physical properties from structure von Katritzky, Alan R., Lobanov, Victor S., Karelson, Mati

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QSPR modeling of flash points: An update von Katritzky, Alan R., Stoyanova-Slavova, Iva B., Dobchev, Dimitar A., Karelson, Mati

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Aromaticity as a Quantitative Concept. 7. Aromaticity Reaffirmed as a Multidimensional Characteristic von Katritzky, Alan R, Karelson, Mati, Sild, Sulev, Krygowski, T. Marek, Jug, Karl

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The Classification of Solvents by Combining Classical QSPR Methodology with Principal Component Analysis von Katritzky, Alan R., Fara, Dan C., Kuanar, Minati, Hur, Evrim, Karelson, Mati

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QSAR study of mosquito repellents using Codessa Pro von Katritzky, Alan R., Dobchev, Dimitar A., Tulp, Indrek, Karelson, Mati, Carlson, David A.

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Antimalarial activity: A QSAR modeling using CODESSA PRO software von Katritzky, Alan R., Kulshyn, Oleksandr V., Stoyanova-Slavova, Iva, Dobchev, Dimitar A., Kuanar, Minati, Fara, Dan C., Karelson, Mati

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Quantum-Chemical Descriptors in QSAR/QSPR Studies von Karelson, Mati, Lobanov, Victor S, Katritzky, Alan R

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