Новиков Александр Сергеевич

Статья

Korepanov O., Aleksandrova O., Botnar A., Firsov D., Kalazhokov Z., Kirilenko D., Lemeshko O., Matveev V., Mazing D., Moskalenko I., Novikov A., Ulasevich S., Moshnikov V. Polyvinylpyrrolidone-Capped CuInS2 Colloidal Quantum Dots: Synthesis, Optical and Structural Assessment. Colloids and Interfaces. 2025. Vol. 9. No. 3. pp. 33.

Статья

Chetinel I., Botnar A.A., Novikov A.S., Muraveva E.A., Ireddy A.T., Zun P.S., Соловьева С.Е., Антипин И., Skorb E.V., Muravev A.A. Control of Self-Organization of Thiacalix[4]Crown-Ethers in Cone and 1,3-Alternate Forms in Nanofilms on Quartz Substrate. Colloid Journal. 2025. Vol. 87. No. 2. pp. 236-245.

Статья

Timofeeva M., Kenzhebayeva Y., Burzak N., Bazhenova A., Lunev A., Novikov A.S., Bondarenko A.B., Shipilovskikh S.A., Dyachuk V.A., Milichko V.A. A light-driven ultrafast sensor based on biocompatible solvatochromic metal-organic frameworks. Materials Horizons. 2025. Vol. 12. No. 4. pp. 1255-1261.

Статья

Normatov S., Nesterov P., Demekhin M.A., Novikov A.S., Skorb E.V. Azide–alkyne cycloaddition catalyzed by Cu(I), Ag(I), and Au(I) complexes and the influence of the deuterium isotope: DFT-based computational insights. New Journal of Chemistry. 2025. Vol. 49. No. 23. pp. 9884-9889.

Статья

Kornilov D.A., Novikov A.S., Nagrimanov R.N., Mustafin A.G. Modification of the High-Pressure Cell in the Hildebrand’s Device to Determine the Thermal Pressure Coefficients of Liquids: Search for Correlations between Thermal Pressure Coefficients and Various Physicochemical Parameters. Journal of Chemical and Engineering Data. 2025. Vol. 70. No. 3. pp. 1208–1214.

Статья

Karalash S.A., Botnar A.A., Aglikov A.S., Muraveva E.A., Kozodaev D.A., Novikov A.S., Skorb E.V., Muravev A.A. AFM and DFT study of diverse self-organization pattern of aminothiacalix[4]arene. Journal of Inclusion Phenomena and Macrocyclic Chemistry. 2025. Vol. 105. No. 3-4. pp. 133–140.

Статья

Antonova M.M., Karshieva S.S., Nikitin A.A., Malinovskaya Y.A., Ermolin D.V., Novikov A.S., Skorb E., Beigulenko D.V., Kovshova T.S., Kalacheva E.A., Filin A.A., Gelperina S.E., Ermolenko Y.V. Colloidal formulations of etoposide based on self-assembling oleyl-hyaluronan-based structures: Optimization of technology and in vitro analysis. Nano-Structures and Nano-Objects. 2025. Vol. 41. pp. 101443.

Статья

Normatov S., Nesterov P., Aliev T., Timralieva A.A., Novikov A.S., Skorb E.V. Search for Correlations Between the Results of the Density Functional Theory and Hartree–Fock Calculations Using Neural Networks and Classical Machine Learning Algorithms. ACS Omega. 2025. Vol. 10. No. 6. pp. 5919–5933.

Статья

Timralieva A.A., Chumakova N., Fionov A.V., Konstantinova E.A., Zaripov R.B., Demekhin M.A., Radchenko M.E., Novikov A.S., Travin S.O., Kokorin A.I., Skorb E.V. Barbituric acid derivative supramolecular assembly as a matrix for oxygen-sensitive photodriven formation of superoxide and carbon-centered radicals. Chemical Physics Letters. 2025. Vol. 868. pp. 141957.

Статья

Timofeeva M., Kenzhebayeva Y., Alekseevskiy P., Efimova A., Abramov A., Shipilovskikh S., Novikov A.S., Somov N.V., Pavlov D.I., Yu X., Potapov A.S., Boulet P., Burzak N., Knyazeva A.R., Li N., Dyachuk V., Milichko V.A. Topological Design of Pyrene-Based Metal-Organic Framework Nanosheets as a Luminescent Thermometer for Live Bioimaging. Advanced Functional Materials. 2025. Vol. 35. No. 36. pp. 2425904.

Статья

Четинел И., Ботнарь А.А., Новиков А.С., Муравьева Е.А., Иредди А., Зун П.С., Соловьева С.Е., Антипин И.С., Скорб Е.В., Муравьев А.А. Контроль самоорганизации тиакаликс[4]краун-эфиров в формах конус и 1,3-альтернат в нанопленках на кварцевой подложке. Коллоидный журнал. 2025. Т. 87. № 2. С. 149-160.

Статья

Tamer T.M., Hassan M., Eltantawy M.M., Brussevich A., Nebalueva A., Volkova O.O., Moskalenko I.V., Novikov A.S., Shityakov S., Marwa M., Ulasevich S., Scorb E. Synthesis and characterization of functionalized chitosan coupled with phenolic aldehyde to thwart antibiotics-resistant bacteria with antioxidant and anti-inflammatory properties: In vitro evaluations and computational investigations. International Journal of Biological Macromolecules. 2025. Vol. 322. No. Part 4. pp. 1-16.

Статья

Ashikhmina M.S., Nesterov P., Filozop V.S., Volodarskiy M.O., Orlova O.Y., Nosonovsky M., Novikov A.S., Skorb E.V. DFT-based evaluation of cryoprotectants and their role in lyophilization success. Cryobiology. 2025. Vol. 120. pp. 105282.

Статья

Obijiofor O., Novikov A.S. Exploring the role of density functional theory in the design of gold nanoparticles for targeted drug delivery: a systematic review. Journal of Molecular Modeling. 2025. Vol. 31. No. 7. pp. 186.

Статья

Muravev A.A., Skorb E.V., Nebalueva A.S., Ermolin D.V., Meshkov A., Pantyukhin I.S., Zenkin A.M., Dergacheva A.P., Novikov A.S., Nikolaev A.A., Vahrushev B.S., Semenov A.V., Andreeva D.V. Smart coacervate catalysis: robotic optimization of Knoevenagel reaction networks. не указано. 2025. Vol. не указан. No. не указан. pp. не указаны.

Статья

Gorab F.D., Aglikov A., Novikov A.S., Nosonovsky M., Ryltseva G., Dudaev A., Menzianova N., Skorb E.V., Shishatskaya E.I. Topography hierarchy of biocompatible polyhydroxyalkanoate film. RSC Advances. 2024. Vol. 14. No. 27. pp. 19603-19611.

Статья

Ghorabe F.D., Novikov A.S., Nesterov P., Ryltseva G.A., Dudaev A.E., Shishatskaya E.I., Skorb E.V. Insight on relationship between crystallinity and band gap energies of polyhydroxyalkanoates polymers. Materials Today Communications. 2024. Vol. 39. pp. 108886.

Статья

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.

Учебник, учебное пособие

Применение программных пакетов Avogadro, ORCA, Putty, WinSCP и CREST для выполнения квантово-химических расчётов

Учебник, учебное пособие

Practice-Oriented Introduction to Machine Learning : Linear Regression, Decision Tree, and Single Layer Perceptron models

Статья

Botnar A.A., Novikov O.P., Korepanov O.A., Muraveva E.A., Kozodaev D.A., Novikov A.S., Nosonovsky M., Skorb E.V., Muravev A.A. Crystallization Control of Anionic Thiacalixarenes on Silicon Surface Coated with Cationic Poly(ethyleneimine). Langmuir. 2024. Vol. 40. No. 46. pp. 24634-24643.

Статья

Zhestkij N.A., Efimova A.S., Kenzhebayeva Y., Dmitriev M.V., Novikov A.S., Yushina I.D., Krylov A., Timofeeva M.V., Kulakova A.N., Glebova N.V., Krasilin A.A., Shipilovskikh S.A., Milichko V.A. Nonlinear Metal-Organic Framework Crystals for Efficient Multicolor Coherent Optical Emission. Advanced Optical Materials. 2023. Vol. 11. No. 22. pp. 2300881.

Статья

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.

Статья

Novikov A.S. Non-Covalent Catalysts. Catalysts. 2023. Vol. 13. No. 2. pp. 339.

Статья

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.

Статья

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.

Статья

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.

Статья

Novikov A.S. Non-Covalent Interactions in Polymers. Polymers. 2023. Vol. 15. No. 5. pp. 1139.

Статья

Novikov A.S. Symmetry in Quantum and Computational Chemistry: Volume 2. Symmetry. 2023. Vol. 15. No. 8. pp. 1472.

Статья

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.

Тезисы

Memristive effect in Ti3C2Tx (MXene) – polyelectrolyte multilayers

Статья

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.

Статья

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.

Статья

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.

Статья

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.

Статья

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.

Статья

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.

Статья

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.

Статья

Masalovich M., Aliev T., Beliaev V.E., Pomytkina A.V., Nesterov P., Shityakov S., Sadovnichii R., Novikov A., Orlova O., Skorb E. The development of an electrochemical sensor for antibiotics in milk based on machine learning algorithms. arXiv.org [база препринтов]. 2022. Vol. arXiv:2212.04422. No. 0. pp. 1-38.

Статья

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.

Статья

Novikov A.S. Theoretical Investigation on Non-Covalent Interactions. Crystals. 2022. Vol. 12. No. 2. pp. 167.

Статья

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.

Статья

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.

Статья

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.

Статья

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. 60. No. 23. pp. 12737-12741.

Тезисы

Thermoresponible macromolecular nanostructures with dynamic properties based on Si nanoparticles

Статья

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.

Статья

Novikov A.S. IsoStar Program Suite for Studies of Noncovalent Interactions in Crystals of Chemical Compounds. Crystals. 2021. Vol. 11. No. 2. pp. 162.

Статья

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 a pH-dependent organic radical trap material. Chemistry - A European Journal. 2020. Vol. 26. No. 70. pp. 16603-16610.

Статья

Novikov A.S. Computational Insights into Industrial Chemistry. Computation. 2020. Vol. 8. No. 4. pp. 97.

Статья

Novikov A.S. Symmetry in quantum and computational chemistry. Symmetry. 2020. Vol. 12. No. 12. pp. 2028.