Babashkina MG - Search Results

1

In silico analyses of betulin: DFT studies, corrosion inhibition properties, ADMET prediction, and molecular docking with a series of SARS-CoV-2 and monkeypox proteins.

Burkhanova TM, Krysantieva AI, Babashkina MG, Konyaeva IA, Monina LN, Goncharenko AN, Safin DA. Burkhanova TM, et al. Among authors: babashkina mg. Struct Chem. 2022 Oct 27:1-12. doi: 10.1007/s11224-022-02079-8. Online ahead of print. Struct Chem. 2022. PMID: 36320318 Free PMC article.

2

α-Aminophosphonates 4-XC₆H₄-NH-CH(4-BrC₆H₄)-P(O)(OiPr)₂ (X = H, Br, MeO): Crystal structures, Hirshfeld surface analysis, computational studies and in silico molecular docking with the SARS-CoV-2 proteins.

Alkhimova LE, Babashkina MG, Safin DA. Alkhimova LE, et al. Among authors: babashkina mg. Tetrahedron. 2021 Sep 24;97:132376. doi: 10.1016/j.tet.2021.132376. Epub 2021 Aug 3. Tetrahedron. 2021. PMID: 34366492 Free PMC article.

3

Computational Analysis of Molnupiravir.

Sharov AV, Burkhanova TM, Taskın Tok T, Babashkina MG, Safin DA. Sharov AV, et al. Among authors: babashkina mg. Int J Mol Sci. 2022 Jan 28;23(3):1508. doi: 10.3390/ijms23031508. Int J Mol Sci. 2022. PMID: 35163429 Free PMC article.

4

Supramolecular structures of Ni^II and Cu^II with the sterically demanding Schiff base dyes driven by cooperative action of preagostic and other non-covalent interactions.

Shiryaev AA, Burkhanova TM, Mitoraj MP, Kukulka M, Sagan F, Mahmoudi G, Babashkina MG, Bolte M, Safin DA. Shiryaev AA, et al. Among authors: babashkina mg. IUCrJ. 2021 May 1;8(Pt 3):351-361. doi: 10.1107/S2052252521000610. eCollection 2021 May 1. IUCrJ. 2021. PMID: 33953922 Free PMC article.

5

A Family of Ethyl N-Salicylideneglycinate Dyes Stabilized by Intramolecular Hydrogen Bonding: Photophysical Properties and Computational Study.

Alkhimova LE, Babashkina MG, Safin DA. Alkhimova LE, et al. Among authors: babashkina mg. Molecules. 2021 May 23;26(11):3112. doi: 10.3390/molecules26113112. Molecules. 2021. PMID: 34070961 Free PMC article.

6

The tetrel bonding role in supramolecular aggregation of lead(II) acetate and a thiosemicarbazide derivative.

Mahmoudi G, García-Santos I, Pittelkow M, Kamounah FS, Zangrando E, Babashkina MG, Frontera A, Safin DA. Mahmoudi G, et al. Among authors: babashkina mg. Acta Crystallogr B Struct Sci Cryst Eng Mater. 2022 Aug 1;78(Pt 4):685-694. doi: 10.1107/S2052520622005789. Epub 2022 Jul 22. Acta Crystallogr B Struct Sci Cryst Eng Mater. 2022. PMID: 35975834

7

Correction: Sharov et al. Computational Analysis of Molnupiravir. Int. J. Mol. Sci. 2022, 23, 1508.

Sharov AV, Burkhanova TM, Taskın Tok T, Babashkina MG, Safin DA. Sharov AV, et al. Among authors: babashkina mg. Int J Mol Sci. 2022 Oct 27;23(21):13026. doi: 10.3390/ijms232113026. Int J Mol Sci. 2022. PMID: 36362453 Free PMC article.

8

Resonance Assisted Hydrogen Bonding Phenomenon Unveiled through Both Experiments and Theory: A New Family of Ethyl N-Salicylideneglycinate Dyes.

Shapenova DS, Shiryaev AA, Bolte M, Kukułka M, Szczepanik DW, Hooper J, Babashkina MG, Mahmoudi G, Mitoraj MP, Safin DA. Shapenova DS, et al. Among authors: babashkina mg. Chemistry. 2020 Oct 9;26(57):12987-12995. doi: 10.1002/chem.202001551. Epub 2020 Sep 3. Chemistry. 2020. PMID: 32428288

9

Tetrel Bonding and Other Non-Covalent Interactions Assisted Supramolecular Aggregation in a New Pb(II) Complex of an Isonicotinohydrazide.

Mahmoudi G, Abedi M, Lawrence SE, Zangrando E, Babashkina MG, Klein A, Frontera A, Safin DA. Mahmoudi G, et al. Among authors: babashkina mg. Molecules. 2020 Sep 4;25(18):4056. doi: 10.3390/molecules25184056. Molecules. 2020. PMID: 32899863 Free PMC article.

10

Correction: On the importance of π-hole spodium bonding in tricoordinated Hg^II complexes.

Mahmoudi G, Masoudiasl A, Babashkina MG, Frontera A, Doert T, White JM, Zangrando E, Zubkov FI, Safin DA. Mahmoudi G, et al. Among authors: babashkina mg. Dalton Trans. 2022 May 24;51(20):8066. doi: 10.1039/d2dt90077g. Dalton Trans. 2022. PMID: 35544995

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