Просмотр коллекции по группе - По тематике COMPUTATIONAL STUDIES
Отображение результатов 1 до 9 из 9
| Дата публикации | Название | Авторы |
| 2021 | Ab initio computational study of the electronic and magnetic properties of the HoNiZ compounds accounting for electronic correlations | Lukoyanov, A. V.; Gramateeva, L. N. |
| 2017 | Computational study of thermal changes during the non-invasive neuro-electrostimulation of the nerve structures in the human neck modelling using finite element method | Kublanov, V.; Babich, M.; Dolganov, A.; Kornilov, F.; Sajler, A. |
| 2016 | Experimental and computational study and development of the bituminous coal entrained-flow air-blown gasifier for IGCC | Abaimov, N. A.; Osipov, P. V.; Ryzhkov, A. F. |
| 2018 | Investigation of coal entrained-flow gasification in O 2 -CO 2 mixtures for oxy-fuel IGCC | Ralnikov, P. A.; Abaimov, N. A.; Ryzhkov, A. F. |
| 2020 | Investigation of multistage air-steam-blown entrained-flow coal gasification | Nikitin, A. D.; Abaimov, N. A.; Butakov, E. B.; Burdukov, A. P.; Ryzhkov, A. F. |
| 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. |
| 2014 | Redox-neutral α-oxygenation of amines: Reaction development and elucidation of the mechanism | Richers, M. T.; Breugst, M.; Platonova, A. Y.; Ullrich, A.; Dieckmann, A.; Houk, K. N.; Seidel, D. |
| 2018 | Structure, dynamics, and thermodynamics of ferrofluids | Camp, P. J. |
| 2021 | 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, L. E.; Babashkina, M. G.; Safin, D. A. |
