Naphthalene-based bis-N-salicylidene aniline dyes: Crystal structures, Hirshfeld surface analysis, computational study and molecular docking with the SARS-CoV-2 proteins

por Burkhanova, Tatyana M., Babashkina, Maria G., Taskin-Tok, Tugba, Sharov, Artem V., Safin, Damir A.
Publicado 2021

Computational Analysis of Molnupiravir

por Sharov, Artem V., Burkhanova, Tatyana M., Taskın Tok, Tugba, Babashkina, Maria G., Safin, Damir A.
Publicado 2022

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

por Sharov, Artem V., Burkhanova, Tatyana M., Taskın Tok, Tugba, Babashkina, Maria G., Safin, Damir A.
Publicado 2022

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

por Burkhanova, Tatyana M., Krysantieva, Alena I., Babashkina, Maria G., Konyaeva, Irina A., Monina, Lyudmila N., Goncharenko, Anastasiya N., Safin, Damir A.
Publicado 2022

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

por Shiryaev, Alexey A., Burkhanova, Tatyana M., Mitoraj, Mariusz P., Kukulka, Mercedes, Sagan, Filip, Mahmoudi, Ghodrat, Babashkina, Maria G., Bolte, Michael, Safin, Damir A.
Publicado 2021