Дата публикации | Название | Авторы |
2023 | Antiviral Potential of Antillogorgia americana and elisabethae Natural Products against nsp16–nsp10 Complex, nsp13, and nsp14 Proteins of SARS-CoV-2: An In Silico Investigation | Pokharkar, O.; Lakshmanan, H.; Zyryanov, G. V.; Tsurkan, M. V. |
2023 | Combination of personalized computational modeling and machine learning for optimization of left ventricular pacing site in cardiac resynchronization therapy | Dokuchaev, A.; Chumarnaya, T.; Bazhutina, A.; Khamzin, S.; Lebedeva, V.; Lyubimtseva, T.; Zubarev, S.; Lebedev, D.; Solovyova, O. |
2023 | Copper(II) Chelates of Schiff Bases Enriched with Aliphatic Fragments: Synthesis, Crystal Structure, In Silico Studies of ADMET Properties and a Potency against a Series of SARS-CoV-2 Proteins | Panova, E. V.; Voronina, J. K.; Safin, D. A. |
2023 | DFT, ADMET, molecular docking and molecular dynamics studies of pyridoxal | Garkusha, N. A.; Anikeeva, O. P.; Bayıl, I.; Taskin-Tok, T.; Safin, D. A. |
2019 | Directed Networks as a Novel Way to Describe and Analyze Cardiac Excitation: Directed Graph Mapping | Vandersickel, N.; Van, Nieuwenhuyse, E.; Van, Cleemput, N.; Goedgebeur, J.; El, Haddad, M.; De, Neve, J.; Demolder, A.; Strisciuglio, T.; Duytschaever, M.; Panfilov, A. V. |
2018 | Dynamical anchoring of distant arrhythmia sources by fibrotic regions via restructuring of the activation pattern | Vandersickel, N.; Watanabe, M.; Tao, Q.; Fostier, J.; Zeppenfeld, K.; Panfilov, A. V. |
2023 | Forward Genetics-Based Approaches to Understanding the Systems Biology and Molecular Mechanisms of Epilepsy | Shevlyakov, A. D.; Kolesnikova, T. O.; de, Abreu, M. S.; Petersen, E. V.; Yenkoyan, K. B.; Demin, K. A.; Kalueff, A. V. |
2022 | In Silico Evaluation of Antifungal Compounds from Marine Sponges against COVID-19-Associated Mucormycosis | Pokharkar, O.; Lakshmanan, H.; Zyryanov, G.; Tsurkan, M. |
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. |
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. |
2021 | Predicting the Most Deleterious Missense Nonsynonymous Single-Nucleotide Polymorphisms of Hennekam Syndrome-Causing CCBE1 Gene, in Silico Analysis | Shinwari, K.; Guojun, L.; Deryabina, S. S.; Bolkov, M. A.; Tuzankina, I. A.; Chereshnev, V. A. |
2019 | R-From-T as a Common Mechanism of Arrhythmia Initiation in Long QT Syndromes | Liu, M. B.; Vandersickel, N.; Panfilov, A. V.; Qu, Z. |
2022 | Searching for novel antagonists of adenosine A1 receptors among azolo[1,5-a]pyrimidine nitro derivatives | Yakovlev, D. S.; Vassiliev, P. M.; Agatsarskaya, Y. V.; Brigadirova, A. A.; Sultanova, K. T.; Skripka, M. O.; Spasov, A. A.; Savateev, K. V.; Rusinov, V. L.; Maltsev, D. V. |
2023 | Towards Novel Potential Molecular Targets for Antidepressant and Antipsychotic Pharmacotherapies | Kositsyn, Y. M.; de, Abreu, M. S.; Kolesnikova, T. O.; Lagunin, A. A.; Poroikov, V. V.; Harutyunyan, H. S.; Yenkoyan, K. B.; Kalueff, A. V. |
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. |
2017 | Компьютерные модели трубопроводных систем | Eremin, A. V.; Stefanyuk, E. V.; Kovaleva, Yu. K.; Popov, A. I.; Borodinov, G. I.; Еремин, А. В.; Стефанюк, Е. В.; Ковалева, Ю. К.; Попов, А.И.; Бородинов, Г. И. |
2015 | Моделирование электромеханических характеристик трехфазного электродвигателя с преобразователем векторно-алгоритмического типа в среде MATLAB SIMULINK | Стальная, М. И.; Еремочкин, С. Ю.; Stalnaya, M. I.; Eremochkin, S. Y. |
2018 | Повышение надежности работы установки непрерывного литья и прессования на основе математического моделирования процессов теплообмена | Скуратов, А. П.; Потапенко, А. С.; Попиякова, Н. П. |
2015 | Создание универсальной модели трехфазного электродвигателя с преобразователем векторно-алгоритмического типа в среде MATLAB SIMULINK | Stalnaya, M. I.; Eremochkin, S. Y.; Стальная, М. И.; Еремочкин, С. Ю. |