Отображение результатов 13 до 32 из 35
< назад
дальше >
| Дата публикации | Название | Авторы |
| 2020 | Hunig's base catalyzed synthesis of new 1-(2,3-dihydro-1H-inden-1-yl)-3-aryl urea/thiourea derivatives as potent antioxidants and 2HCK enzyme growth inhibitors | Lachhi, Reddy, V.; Avula, V. K. R.; Zyryanov, G. V.; Vallela, S.; Anireddy, J. S.; Pasupuleti, V. R.; Chamarthi, N. R.; Зырянов, Г. В. |
| 2023 | Identification of RdRp inhibitors against SARS-CoV-2 through E-pharmacophore-based virtual screening, molecular docking and MD simulations approaches | Rehman, H. M.; Sajjad, M.; Ali, M. A.; Gul, R.; Naveed, M.; Aslam, M. S.; Shinwari, K.; Bhinder, M. A.; Ghani, M. U.; Saleem, M.; Rather, M. A.; Ahmad, I.; Amin, A. |
| 2023 | 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, T. M.; Krysantieva, A. I.; Babashkina, M. G.; Konyaeva, I. A.; Monina, L. N.; Goncharenko, A. N.; Safin, D. A. |
| 2022 | In Silico Analysis Revealed Five Novel High-Risk Single-Nucleotide Polymorphisms (rs200384291, rs201163886, rs193141883, rs201139487, and rs201723157) in ELANE Gene Causing Autosomal Dominant Severe Congenital Neutropenia 1 and Cyclic Hematopoiesis | Shinwari, K.; Bolkov, M. A.; Yasir Akbar, M.; Guojun, L.; Deryabina, S. S.; Tuzankina, I. A.; Chereshnev, V. A. |
| 2022 | In Silico Evaluation of Antifungal Compounds from Marine Sponges against COVID-19-Associated Mucormycosis | Pokharkar, O.; Lakshmanan, H.; Zyryanov, G.; Tsurkan, M. |
| 2023 | Indolyl-Derived 4H-Imidazoles: PASE Synthesis, Molecular Docking and In Vitro Cytotoxicity Assay | Nikiforov, E. A.; Vaskina, N. F.; Moseev, T. D.; Varaksin, M. V.; Butorin, I. I.; Melekhin, V. V.; Tokhtueva, M. D.; Mazhukin, D. G.; Tikhonov, A. Y.; Charushin, V. N.; Chupakhin, O. N. |
| 2023 | An insight from computational approach to explore novel, high-affinity phosphodiesterase 10A inhibitors for neurological disorders | Sharma, B.; Bhattacherjee, D.; Zyryanov, G. V.; Purohit, R. |
| 2022 | Naphthalene-based bis-N-salicylidene aniline dyes: Crystal structures, Hirshfeld surface analysis, computational study and molecular docking with the SARS-CoV-2 proteins | Burkhanova, T. M.; Babashkina, M. G.; Taskin-Tok, T.; Sharov, A. V.; Safin, D. A. |
| 2023 | Natural Products from Marine Actinomycete Genus Salinispora Might Inhibit 3CLpro and PLpro Proteins of SARS-CoV-2: An In Silico Evidence | Pokharkar, O.; Zyryanov, G. V.; Tsurkan, M. V. |
| 2023 | Natural Products from Red Algal Genus Laurencia as Potential Inhibitors of RdRp and nsp15 Enzymes of SARS-CoV-2: An In Silico Perspective | Pokharkar, O.; Anumolu, H.; Zyryanov, G. V.; Tsurkan, M. V. |
| 2023 | A Novel Ambroxol-Derived Tetrahydroquinazoline with a Potency against SARS-CoV-2 Proteins | Krysantieva, A. I.; Voronina, J. K.; Safin, D. A. |
| 2023 | A novel coumarin-triazole-thiophene hybrid: synthesis, characterization, ADMET prediction, molecular docking and molecular dynamics studies with a series of SARS-CoV-2 proteins | Omar, R. A.; Koparir, P.; Sarac, K.; Koparir, M.; Safin, D. A. |
| 2020 | Novel pyranopyrazole derivatives comprising a benzoxazole core as antimicrobial inhibitors: Design, synthesis, microbial resistance and machine aided results | Reddy, G. M.; Kumari, A. K.; Reddy, V. H.; Garcia, J. R. |
| 2018 | On a Generalized Levinthal's Paradox: The Role of Long- and Short Range Interactions in Complex Bio-molecular Reactions, Including Protein and DNA Folding | Melkikh, A. V.; Meijer, D. K. F. |
| 2023 | Powerful Potential of Polyfluoroalkyl-Containing 4-Arylhydrazinylidenepyrazol-3-ones for Pharmaceuticals | Burgart, Y. V.; Elkina, N. A.; Shchegolkov, E. V.; Krasnykh, O. P.; Makhaeva, G. F.; Triandafilova, G. A.; Solodnikov, S. Y.; Boltneva, N. P.; Rudakova, E. V.; Kovaleva, N. V.; Serebryakova, O. G.; Ulitko, M. V.; Borisevich, S. S.; Gerasimova, N. A.; Evstigneeva, N. P.; Kozlov, S. A.; Korolkova, Y. V.; Minin, A. S.; Belousova, A. V.; Mozhaitsev, E. S.; Klabukov, A. M.; Saloutin, V. I. |
| 2023 | Resistance to Resveratrol Treatment in Experimental PTSD Is Associated with Abnormalities in Hepatic Metabolism of Glucocorticoids | Tseilikman, V. E.; Fedotova, J. O.; Tseilikman, O. B.; Novak, J.; Karpenko, M. N.; Maistrenko, V. A.; Lazuko, S. S.; Belyeva, L. E.; Kamel, M.; Buhler, A. V.; Kovaleva, E. G. |
| 2020 | Structure-based virtual screening of pseudomonas aeruginosa lpxa inhibitors using pharmacophore-based approach | Bhaskar, B. V.; Babu, T. M. C.; Rammohan, A.; Zheng, G. Y.; Zyryanov, G. V.; Gu, W.; Зырянов, Г. В. |
| 2023 | Study of the Molecular Architectures of 2-(4-Chlorophenyl)-5-(pyrrolidin-1-yl)-2H-1,2,3-triazole-4-carboxylic Acid Using Their Vibrational Spectra, Quantum Chemical Calculations and Molecular Docking with MMP-2 Receptor | Palafox, M. A.; Belskaya, N. P.; Kostova, I. P. |
| дек-2022 | Substituted benzocoumarin derivatives: synthesis, characterization, biological activities and molecular docking with ADME studies | Megha G. V.; Bodke, Yadav D.; Shanavaz, H.; Muthipeedika, Nibin Joy |
| 2020 | Synthesis of novel cytotoxic tetracyclic acridone derivatives and study of their molecular docking, ADMET, QSAR, bioactivity and protein binding properties | Veligeti, R.; Madhu, R. B.; Anireddy, J.; Pasupuleti, V. R.; Avula, V. K. R.; Ethiraj, K. S.; Uppalanchi, S.; Kasturi, S.; Perumal, Y.; Anantaraju, H. S.; Polkam, N.; Guda, M. R.; Vallela, S.; Zyryanov, G. V.; Зырянов, Г. В. |
