Andriy Kovalenko - Search Results

Year	Number of Results
2004	1
2005	7
2006	6
2007	8
2008	5
2009	8
2010	12
2011	7
2012	4
2013	4
2014	3
2015	5
2016	3
2017	2
2018	2
2019	10
2020	3
2021	3
2022	3
2023	1
2024	0

1

Biomolecular Simulations with the Three-Dimensional Reference Interaction Site Model with the Kovalenko-Hirata Closure Molecular Solvation Theory.

Roy D, Kovalenko A. Roy D, et al. Among authors: kovalenko a. Int J Mol Sci. 2021 May 11;22(10):5061. doi: 10.3390/ijms22105061. Int J Mol Sci. 2021. PMID: 34064655 Free PMC article. Review.

2

Substance P analogs devoid of key residues fail to activate human mast cells via MRGPRX2.

Raj S, Hlushak S, Arizmendi N, Kovalenko A, Kulka M. Raj S, et al. Among authors: kovalenko a. Front Immunol. 2023 May 9;14:1155740. doi: 10.3389/fimmu.2023.1155740. eCollection 2023. Front Immunol. 2023. PMID: 37228611 Free PMC article.

3

Predicting PAMPA permeability using the 3D-RISM-KH theory: are we there yet?

Roy D, Dutta D, Wishart DS, Kovalenko A. Roy D, et al. Among authors: kovalenko a. J Comput Aided Mol Des. 2021 Feb;35(2):261-269. doi: 10.1007/s10822-020-00364-4. Epub 2021 Jan 4. J Comput Aided Mol Des. 2021. PMID: 33392947

4

A closure relation to molecular theory of solvation for macromolecules.

Kobryn AE, Gusarov S, Kovalenko A. Kobryn AE, et al. Among authors: kovalenko a. J Phys Condens Matter. 2016 Oct 12;28(40):404003. doi: 10.1088/0953-8984/28/40/404003. Epub 2016 Aug 23. J Phys Condens Matter. 2016. PMID: 27549008

5

Predicting Accurate Solvation Free Energy in n-Octanol Using 3D-RISM-KH Molecular Theory of Solvation: Making Right Choices.

Roy D, Blinov N, Kovalenko A. Roy D, et al. Among authors: kovalenko a. J Phys Chem B. 2017 Oct 5;121(39):9268-9273. doi: 10.1021/acs.jpcb.7b06375. Epub 2017 Sep 25. J Phys Chem B. 2017. PMID: 28880087

6

Molecular interactions between monoclonal oligomer-specific antibody 5E3 and its amyloid beta cognates.

Khorvash M, Blinov N, Ladner-Keay C, Lu J, Silverman JM, Gibbs E, Wang YT, Kovalenko A, Wishart D, Cashman NR. Khorvash M, et al. Among authors: kovalenko a. PLoS One. 2020 May 29;15(5):e0232266. doi: 10.1371/journal.pone.0232266. eCollection 2020. PLoS One. 2020. PMID: 32469918 Free PMC article.

7

Cellulose Aggregation under Hydrothermal Pretreatment Conditions.

Silveira RL, Stoyanov SR, Kovalenko A, Skaf MS. Silveira RL, et al. Among authors: kovalenko a. Biomacromolecules. 2016 Aug 8;17(8):2582-90. doi: 10.1021/acs.biomac.6b00603. Epub 2016 Jul 5. Biomacromolecules. 2016. PMID: 27301535

8

Understanding the Liquid States of Cyclic Hydrocarbons Containing N, O, and S Atoms via the 3D-RISM-KH Molecular Solvation Theory.

Roy D, Kovalenko A. Roy D, et al. Among authors: kovalenko a. Molecules. 2022 Oct 4;27(19):6563. doi: 10.3390/molecules27196563. Molecules. 2022. PMID: 36235097 Free PMC article.

9

A molecular theory of liquid interfaces.

Kovalenko A, Hirata F. Kovalenko A, et al. Phys Chem Chem Phys. 2005 Apr 21;7(8):1785-93. doi: 10.1039/b416615a. Phys Chem Chem Phys. 2005. PMID: 19787939

10

3D-RISM-Dock: A New Fragment-Based Drug Design Protocol.

Nikolić D, Blinov N, Wishart D, Kovalenko A. Nikolić D, et al. Among authors: kovalenko a. J Chem Theory Comput. 2012 Sep 11;8(9):3356-72. doi: 10.1021/ct300257v. Epub 2012 Aug 21. J Chem Theory Comput. 2012. PMID: 26605742

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