Katritzky AR - Search Results

1

Correlation of blood-brain penetration using structural descriptors.

Katritzky AR, Kuanar M, Slavov S, Dobchev DA, Fara DC, Karelson M, Acree WE Jr, Solov'ev VP, Varnek A. Katritzky AR, et al. Bioorg Med Chem. 2006 Jul 15;14(14):4888-917. doi: 10.1016/j.bmc.2006.03.012. Epub 2006 May 11. Bioorg Med Chem. 2006. PMID: 16697202

2

Six-membered cyclic ureas as HIV-1 protease inhibitors: a QSAR study based on CODESSA PRO approach. Quantitative structure-activity relationships.

Katritzky AR, Oliferenko A, Lomaka A, Karelson M. Katritzky AR, et al. Bioorg Med Chem Lett. 2002 Dec 2;12(23):3453-7. doi: 10.1016/s0960-894x(02)00741-2. Bioorg Med Chem Lett. 2002. PMID: 12419382

3

The present utility and future potential for medicinal chemistry of QSAR/QSPR with whole molecule descriptors.

Katritzky AR, Fara DC, Petrukhin RO, Tatham DB, Maran U, Lomaka A, Karelson M. Katritzky AR, et al. Curr Top Med Chem. 2002 Dec;2(12):1333-56. doi: 10.2174/1568026023392922. Curr Top Med Chem. 2002. PMID: 12470284 Review.

4

Quantitative structure-property relationship modeling of beta-cyclodextrin complexation free energies.

Katritzky AR, Fara DC, Yang H, Karelson M, Suzuki T, Solov'ev VP, Varnek A. Katritzky AR, et al. J Chem Inf Comput Sci. 2004 Mar-Apr;44(2):529-41. doi: 10.1021/ci034190j. J Chem Inf Comput Sci. 2004. PMID: 15032533

5

QSPR of 3-aryloxazolidin-2-one antibacterials.

Katritzky AR, Fara DC, Karelson M. Katritzky AR, et al. Bioorg Med Chem. 2004 Jun 1;12(11):3027-35. doi: 10.1016/j.bmc.2004.03.013. Bioorg Med Chem. 2004. PMID: 15142561

6

QSPR treatment of rat blood:air, saline:air and olive oil:air partition coefficients using theoretical molecular descriptors.

Katritzky AR, Kuanar M, Fara DC, Karelson M, Acree WE Jr. Katritzky AR, et al. Bioorg Med Chem. 2004 Sep 1;12(17):4735-48. doi: 10.1016/j.bmc.2004.05.028. Bioorg Med Chem. 2004. PMID: 15294307

7

QSAR treatment of drugs transfer into human breast milk.

Katritzky AR, Dobchev DA, Hür E, Fara DC, Karelson M. Katritzky AR, et al. Bioorg Med Chem. 2005 Mar 1;13(5):1623-32. doi: 10.1016/j.bmc.2004.12.015. Bioorg Med Chem. 2005. PMID: 15698780

8

QSAR modeling of blood:air and tissue:air partition coefficients using theoretical descriptors.

Katritzky AR, Kuanar M, Fara DC, Karelson M, Acree WE Jr, Solov'ev VP, Varnek A. Katritzky AR, et al. Bioorg Med Chem. 2005 Dec 1;13(23):6450-63. doi: 10.1016/j.bmc.2005.06.066. Epub 2005 Oct 3. Bioorg Med Chem. 2005. PMID: 16202613

9

QSAR studies on 1-phenylbenzimidazoles as inhibitors of the platelet-derived growth factor.

Katritzky AR, Dobchev DA, Fara DC, Karelson M. Katritzky AR, et al. Bioorg Med Chem. 2005 Dec 15;13(24):6598-608. doi: 10.1016/j.bmc.2005.06.067. Epub 2005 Oct 17. Bioorg Med Chem. 2005. PMID: 16230017

10

Antimalarial activity: a QSAR modeling using CODESSA PRO software.

Katritzky AR, Kulshyn OV, Stoyanova-Slavova I, Dobchev DA, Kuanar M, Fara DC, Karelson M. Katritzky AR, et al. Bioorg Med Chem. 2006 Apr 1;14(7):2333-57. doi: 10.1016/j.bmc.2005.11.015. Epub 2006 Jan 19. Bioorg Med Chem. 2006. PMID: 16426851

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