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artikkel ajakirjas

Comparison between 2D and 3D-QSAR approaches to correlate inhibitor activity for a series of indole amide hydroxamic acidKatritzky, Alan R.; Slavov, Svetoslav; Dobchev, Dimitar; Karelson, MatiQSAR & combinatorial science2007 / 3, p. 333-345 https://onlinelibrary.wiley.com/doi/abs/10.1002/qsar.200630021

artikkel ajakirjas

2

artikkel ajakirjas

Correlation of blood-brain penetration and human serum albumin binding with theoretical descriptiorsKarelson, Mati; Dobchev, Dimitar; Tamm, Tarmo; Tulp, Indrek; Jänes, Jaak; Tämm, Kaido; Lomaka, Andre; Savchenko, Deniss; Karelson, GunnarArkivoc2008 / XVI, p. 38-60 : ill https://www.arkat-usa.org/get-file/26925/

artikkel ajakirjas

3

artikkel ajakirjas

Fragment-based development of HCV protease inhibitors for the treatment of hepatitis CKarelson, Mati; Dobchev, Dimitar; Karelson, Gunnar; Tamm, Tarmo; Tämm, Kaido; Nikonov, Andrei; Mutso, Margit; Merits, AndresCurrent computer-aided drug design2012 / p. 55-61 https://www.researchgate.net/publication/221745366_Fragment-Based_Development_of_HCV_Protease_Inhibitors_for_the_Treatment_of_Hepatitis_C

artikkel ajakirjas

4

artikkel ajakirjas

Legitimate utilization of large descriptor pools for QSPR/QSAR modelsKatritzky, Alan R.; Dobchev, Dimitar; Slavov, Svetoslav; Karelson, MatiJournal of chemical information and modeling2008 / 11, p. 2207-2213 : ill

artikkel ajakirjas

5

artikkel ajakirjas

Novel computational models for predicting dopamine interactionsKatritzky, Alan R.; Dobchev, Dimitar; Stoyanova-Slavova, Iva B.; Kuanar, Minati; Bespalov, Maxim M.; Karelson, Mati; Saarma, MartExperimental neurology2008 / 1, p. 150-171

artikkel ajakirjas

6

artikkel ajakirjas

QSAR modeling of the antifungal activity against Candida albicans for a diverse set of organic compoundsKatritzky, Alan R.; Slavov, Svetoslav; Dobchev, Dimitar; Karelson, MatiBioorganic & medicinal chemistry2008 / 14, p. 7055-7069 : ill

artikkel ajakirjas

7

artikkel ajakirjas

QSAR study of pharmacological permeabilitiesKarelson, Mati; Karelson, Gunnar; Tamm, Tarmo; Tulp, Indrek; Jänes, Jaak; Tämm, Kaido; Lomaka, Andre; Savtšenko, Deniss; Dobchev, DimitarArkivoc2009 / 2, p. 218-238 : ill https://citeseerx.ist.psu.edu/document?repid=rep1&type=pdf&doi=04010557f978e40f8e33b61f9570340690f7940e

artikkel ajakirjas

8

artikkel ajakirjas

QSPR modeling of flash points : an updateKatritzky, Alan R.; Stoyanova-Slavova, Iva B.; Dobchev, Dimitar; Karelson, MatiJournal of molecular graphics and modelling2007 / 2, p. 529-536 : ill https://www.sciencedirect.com/science/article/pii/S1093326307000617

artikkel ajakirjas

9

artikkel ajakirjas

QSPR modeling of hyperpolarizabilitiesKatritzky, Alan R.; Pacureanu, Liliana; Dobchev, Dimitar; Karelson, MatiJournal of molecular modeling2007 / 9, p. 951-963 : ill https://www.researchgate.net/publication/6267202_QSPR_modeling_of_hyperpolarizabilities

artikkel ajakirjas

10

artikkel ajakirjas

QSPR modeling of UV absorption intensitiesKatritzky, Alan R.; Slavov, Svetoslav; Dobchev, Dimitar; Karelson, MatiJournal of computer-aided molecular design2007 / 7, p. 371-377 https://www.researchgate.net/publication/6272883_QSPR_modeling_of_UV_absorption_intensities

artikkel ajakirjas

11

artikkel ajakirjas

QSPR study of critical micelle concentration of anionic surfactants using computational molecular descriptorsKaritzky, Alan R.; Pacureanu, Liliana; Dobchev, Dimitar; Karelson, MatiJournal of chemical information and modeling2007 / 3, p. 782-793 https://pubs.acs.org/doi/10.1021/ci600462d

artikkel ajakirjas

12

artikkel ajakirjas

Quantitative structure-property relationship studies on Ostwald solubility and partition coefficients of organic solutes in ionic liquidsKatritzky, Alan R.; Kuanar, Minati; Stoyanova-Slavova, Iva B.; Slavov, Svetoslav H.; Dobchev, Dimitar; Karelson, Mati; Acree, William jrJournal of chemical and engineering data2008 / 5, p. 1085-1092

artikkel ajakirjas

13

artikkel ajakirjas

Rapid QSPR model development technique for prediction of vapor pressure of organic compoundsKatritzky, Alan R.; Slavov, Svetoslav; Dobchev, Dimitar; Karelson, MatiComputers & chemical engineering2007 / 9, p. 1123-1130 https://www.sciencedirect.com/science/article/pii/S0098135406002511

artikkel ajakirjas

14

artikkel ajakirjas

Synthesis and bioassay of improved mosquito repellents predicted from chemical structureKatritzky, Alan R.; Wang, Zuoquan; Slavov, Svetoslav; Tsikolia, Maia; Dobchev, DimitarProceedings of the National Academy of Sciences of the United States of America2008 / 21, p. 7359-7364

artikkel ajakirjas

15

artikkel ajakirjas

Using artificial neural networks to predict cell-penetrating compoundsKarelson, Mati; Dobchev, DimitarExpert opinion drug discovery2011 / p. 783-796 : ill

artikkel ajakirjas

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