Научные руководители
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Новиков Александр Сергеевичкандидат химических наук novikov@itmo.ru Структурное подразделение: научно-образовательный центр инфохимии Должность: доцент (квалификационная категория "ординарный доцент") Профиль: 1.4.1. - Неорганическая химия 1.4.4. - Физическая химия Область интересов: Вычислительная химия, квантовая химия, компьютерное моделирование в химии, супрамолекулярная химия, механизмы химических реакций, нековалентные взаимодействия, анализ больших объёмов данных Рабочий язык: Английский, Русский |
Публикации руководителя
| Выходные данные | Год | Индексирование в БД |
| Klyukin I.N., Kolbunova A.V., Novikov A.S., Zhizhin K.Y., Kuznetsov N.T. Theoretical investigation of CB5H6(Hfac) and CB5H5(H2) carboranes: combined MO and QTAIM analysis//Computational and Theoretical Chemistry, 2024, Vol. 1231, pp. 114434 | 2024 | Scopus, Web of Science |
| Aliev T., Belyaev V.E., Pomytkina A.V., Nesterov P., Shityakov S., Sadovnichii R., Novikov A.S., Orlova O.Y., Masalovich M.S., Skorb E.V. Electrochemical Sensor to Detect Antibiotics in Milk Based on Machine Learning Algorithms//ACS Applied Materials and Interfaces, 2023, Vol. 15, No. 44, pp. 52010-52020 | 2023 | Scopus, Web of Science |
| Moskalenko I.V., Shilovskikh V., Nesterov P., Novikov A.S., Omarova M., Sadovnichii R., Gurzhiy V.V., Orekhov N., Skorb E.V. Supramolecular Assemblies of Melamine-2-Thiobarbiturate and Melamine-Barbiturate-2-Thiobarbiturate: Experimental and Theoretical Studies//Crystals, 2023, Vol. 13, No. 9, pp. 1320 | 2023 | Scopus, Web of Science |
| Moskalenko I., Borodin L.I., Novikov A.S. Oxidation of Methyl Linoleate in Triton X-100 Micelles Initiated by Lipid-soluble Initiator 2,2?-Azobis (2,4-dimethylvaleronitrile)//ChemistrySelect, 2023, Vol. 8, No. 25, pp. e202301357 | 2023 | Scopus, Web of Science |
| Klyukin I.N., Kolbunova A.V., Novikov A.S., Zhdanov A.P., Zhizhin K.Y., Kuznetsov N.T. Theoretical Insight on the Formation Mechanism of a Trisubstituted Derivative of Closo-Decaborate Anion [B10H7O2CCH3(NCCH3)]0//Inorganics, 2023, Vol. 11, No. 5, pp. 201 | 2023 | Scopus, Web of Science |
| Novikov A.S. Non-Covalent Catalysts//Catalysts, 2023, Vol. 13, No. 2, pp. 339 | 2023 | Scopus, Web of Science |
| Novikov A.S. Non-Covalent Interactions in Polymers//Polymers, 2023, Vol. 15, No. 5, pp. 1139 | 2023 | Scopus, Web of Science |
| Savintseva L., Avdoshin A., Ignatov S., Novikov A.S. Theoretical Study of Charge Mobility in Crystal Porphine and a Computer Design of a Porphine-Based Semiconductive Discotic Liquid Mesophase//International Journal of Molecular Sciences, 2023, Vol. 24, No. 1, pp. 736 | 2023 | Scopus, Web of Science |
| Tamer T.M., Eltantawy M.M., Brussevich A., Nebalueva A., Novikov A., Moskalenko I.V., Abu-Serie M.M., Hassan M., Ulasevich S., Skorb E.V. Functionalization of chitosan with poly aromatic hydroxyl molecules for improving its antibacterial and antioxidant properties Practical and theoretical studies//International Journal of Biological Macromolecules, 2023, Vol. 234, pp. 123687 | 2023 | Scopus, Web of Science |
| Timralieva A.A., Moskalenko I.V., Nesterov P., Shilovskikh V.V., Novikov A.S., Konstantinova E.A., Kokorin A.I., Skorb E.V. Melamine Barbiturate as a Light-Induced Nanostructured Supramolecular Material for a Bioinspired Oxygen and Organic Radical Trap and Stabilization//ACS Omega, 2023, Vol. 8, No. 9, pp. 8276–8284 | 2023 | Scopus, Web of Science |
| Aglikov A., Volkova O., Bondar A., Moskalenko I., Novikov A., Skorb E.V., Smirnov E. Memristive Effect in Ti3C2Tx (MXene) Polyelectrolyte Multilayers//ChemPhysChem, 2023, Vol. 24, No. 17, pp. e202300187 | 2023 | Scopus, Web of Science |
| Novikov A.S. Symmetry in Quantum and Computational Chemistry: Volume 2//Symmetry, 2023, Vol. 15, No. 8, pp. 1472 | 2023 | Scopus, Web of Science |
| Lorits E.M., Gubar E.A., Novikov A.S. Design of the Algorithm for Packaging of Water Molecules in a Fixed Volume//Symmetry, 2022, Vol. 14, No. 11, pp. 2453 | 2022 | Scopus, Web of Science |
| Novikov A.S. Theoretical Investigation on Non-Covalent Interactions//Crystals, 2022, Vol. 12, No. 2, pp. 167 | 2022 | Scopus, Web of Science |
| Novikov A.S. Plethora of Non-Covalent Interactions in Coordination and Organometallic Chemistry Are Modern Smart Tool for Materials Science, Catalysis, and Drugs Design//International Journal of Molecular Sciences, 2022, Vol. 23, No. 23, pp. 14767 | 2022 | Scopus, Web of Science |
| Novikov A.S. Theoretical Studies and Computer Modeling of Supramolecular Chemical Systems: Structure, Properties and Reactivity//Chemistry Proceedings, 2022, Vol. 12, No. 1, pp. 88 | 2022 | |
| Nebalueva A.S., Timralieva A.A., Sadovnichii R., Novikov A.S., Zhukov M.V., Aglikov A.S., Muravev A.A., Sviridova T.V., Boyarskiy V.P., Kholkin A.L., Skorb E.V. Piezo-Responsive Hydrogen-Bonded Frameworks Based on Vanillin-Barbiturate Conjugates//Molecules, 2022, Vol. 27, No. 17, pp. 5659 | 2022 | Scopus, Web of Science |
| Novikov A.S., Bolotin D.S. Halonium, chalconium, and pnictonium salts as noncovalent organocatalysts: a computational study on relative catalytic activity//Organic and Biomolecular Chemistry, 2022, Vol. 20, No. 38, pp. 7632–7639 | 2022 | Scopus, Web of Science |
| Nikitina A.A., Milichko V.A., Novikov A.S., Larin A.O., Nandy P., Mirsaidov U., Andreeva D.V., Rybin M.V., Kivshar Y.S., Skorb E.V. All-Dielectric Nanostructures with a Thermoresponsible Dynamic Polymer Shell//Angewandte Chemie - International Edition, 2021, Vol. 20, No. 23, pp. 12737-12741 | 2021 | Scopus, Web of Science |
| Novikov A.S. IsoStar Program Suite for Studies of Noncovalent Interactions in Crystals of Chemical Compounds//Crystals, 2021, Vol. 11, No. 2, pp. 162 | 2021 | Scopus, Web of Science |
| Ivanov A.S., Nikolaev K.G., Novikov A.S., Yurchenko S.O., Novoselov K.S., Andreeva D.V., Skorb E.V. Programmable Soft-Matter Electronics//Journal of Physical Chemistry Letters, 2021, Vol. 12, No. 7, pp. 2017-2022 | 2021 | Scopus, Web of Science |
| Nesterov P.V., Shilovskikh V.V., Sokolov A., Gurzhiy V.V., Novikov A.S., Timralieva A.A., Belogub E.V., Kondratyuk N., Orekhov N., Skorb E.V. Encapsulation of Rhodamine 6G Dye Molecules for Affecting Symmetry of Supramolecular Crystals of Melamine-Barbiturate//Symmetry, 2021, Vol. 13, No. 7, pp. 1119 | 2021 | Scopus, Web of Science |
| Malyshkina M.V., Novikov A.S. Modern Software for Computer Modeling in Quantum Chemistry and Molecular Dynamics//Compounds, 2021, Vol. 1, No. 3, pp. 134–144 | 2021 | |
| Imoro N., Shilovskikh V., Nesterov P., Timralieva A.A., Gets D.S., Nebalueva A.S., Lavrentev F., Novikov A.S., Kondratyuk N.D., Orekhov N.D., Skorb E.V. Biocompatible pH-Degradable Functional Capsules Based on Melamine Cyanurate Self-Assembly//ACS Omega, 2021, Vol. 6, No. 27, pp. 17267–17275 | 2021 | Scopus, Web of Science |
| Novikov A.S. Symmetry in quantum and computational chemistry//Symmetry, 2020, Vol. 12, No. 12, pp. 2028 | 2020 | Scopus, Web of Science |
| Novikov A.S. Computational Insights into Industrial Chemistry//Computation, 2020, Vol. 8, No. 4, pp. 97 | 2020 | Scopus, Web of Science |
| Skorb E.V., Shilovskikh V.V., Timralieva A.A., Nesterov P.V., Novikov A.S., Sitnikov P.A., Konstantinova E.A., Kokorin A.I. Melamine-barbiturate supramolecular assembly as pH-dependent organic radical trap material//Chemistry - A European Journal, 2020, Vol. 26, No. 70, pp. 16603-16610 | 2020 | Scopus, Web of Science |