Discovery of New Ginsenol-Like Compounds with High Antiviral Activity
Volobueva, Aleksandrina S., Yarovaya, Olga I., Kireeva, Marina V., Borisevich, Sophia S., Kovaleva, Kseniya S., Mainagashev, Iliya Ya, Gatilov, Yuri V., Ilyina, Margarita G., Zarubaev, Vladimir V., Salakhutdinov, Nariman F.
Published in Molecules (Basel, Switzerland) (10.11.2021)
Published in Molecules (Basel, Switzerland) (10.11.2021)
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Journal Article
Optical Configuration Effect on the Structure and Reactivity of Diastereomers Revealed by Spin Effects and Molecular Dynamics Calculations
Ageeva, Aleksandra A, Doktorov, Alexander B, Selyutina, Olga Yu, Magin, Ilya M, Ilyina, Margarita G, Borisevich, Sophia S, Rubtsov, Ruslan Yu, Khursan, Sergey L, Stepanov, Alexander A, Vasilevsky, Sergey F, Polyakov, Nikolay E, Leshina, Tatyana V
Published in International journal of molecular sciences (21.12.2021)
Published in International journal of molecular sciences (21.12.2021)
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Journal Article
Determining the Oxidation Stability of Electrolytes for Lithium-Ion Batteries Using Quantum Chemistry and Molecular Dynamics
Evshchik, Elizaveta Y., Borisevich, Sophia S., Ilyina, Margarita G., Khamitov, Edward M., Chernyak, Alexander V., Pugacheva, Tatiana A., Kolmakov, Valery G., Bushkova, Olga V., Dobrovolsky, Yuri A.
Published in Electrochem (Basel, Switzerland) (01.03.2024)
Published in Electrochem (Basel, Switzerland) (01.03.2024)
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Journal Article
QC and MD Modelling for Predicting the Electrochemical Stability Window of Electrolytes: New Estimating Algorithm
Dobrovolsky, Yuri A., Ilyina, Margarita G., Evshchik, Elizaveta Y., Khamitov, Edward M., Chernyak, Alexander V., Shikhovtseva, Anna V., Melnikova, Tatiana I., Bushkova, Olga V., Borisevich, Sophia S.
Published in Batteries (Basel) (01.12.2022)
Published in Batteries (Basel) (01.12.2022)
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2-Arylhydrazinylidene-3-oxo-3-polyfluoroalkylpropanoic acids as selective and effective carboxylesterase inhibitors with powerful antioxidant potential
Burgart, Yanina V., Makhaeva, Galina F., Khudina, Olga G., Krasnykh, Olga P., Kovaleva, Nadezhda V., Elkina, Natalia A., Boltneva, Natalia P., Rudakova, Elena V., Lushchekina, Sofya V., Shchegolkov, Evgeny V., Triandafilova, Galina A., Malysheva, Ksenia O., Serebryakova, Olga G., Borisevich, Sophia S., Ilyina, Margarita G., Zhilina, Ekaterina F., Saloutin, Victor I., Charushin, Valery N., Richardson, Rudy J.
Published in Bioorganic & medicinal chemistry (01.12.2024)
Published in Bioorganic & medicinal chemistry (01.12.2024)
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Journal Article
Theoretical Models for Quantitative Description of the Acid–Base Equilibria of the 5,6-Substituted Uracils
Ilyina, Margarita G, Khamitov, Edward M, Ivanov, Sergey P, Mustafin, Akhat G, Khursan, Sergey L
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (11.01.2018)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (11.01.2018)
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Journal Article
2-Aryl-1-hydroxyimidazoles possessing antiviral activity against a wide range of orthopoxviruses, including the variola virus
Basanova, Elizaveta I, Kulikova, Ekaterina A, Bormotov, Nikolai I, Serova, Olga A, Shishkina, Larisa N, Ovchinnikova, Alyona S, Odnoshevskiy, Dmitry A, Pyankov, Oleg V, Agafonov, Alexander P, Yarovaya, Olga I, Borisevich, Sophia S, Ilyina, Margarita G, Kolybalov, Dmitry S, Arkhipov, Sergey G, Bogdanov, Nikita E, Pavlova, Marina A, Salakhutdinov, Nariman F, Perevalov, Valery P, Nikitina, Polina A
Published in MedChemComm (05.07.2024)
Published in MedChemComm (05.07.2024)
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Journal Article
The Nitro Group Reshapes the Effects of Pyrido[3,4- g ]quinazoline Derivatives on DYRK/CLK Activity and RNA Splicing in Glioblastoma Cells
Borisevich, Sophia S, Aksinina, Tatiana E, Ilyina, Margarita G, Shender, Victoria O, Anufrieva, Ksenia S, Arapidi, Georgij P, Antipova, Nadezhda V, Anizon, Fabrice, Esvan, Yannick J, Giraud, Francis, Tatarskiy, Victor V, Moreau, Pascale, Shakhparonov, Mikhail I, Pavlyukov, Marat S, Shtil, Alexander A
Published in Cancers (19.02.2024)
Published in Cancers (19.02.2024)
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Journal Article
A molecular dynamics simulation of the chemisorption of the optical isomers of propranolol on the graphitic electrode modified with melamine, cyanuric, and isocyanuric acids
Ilyina, Margarita G., Khamitov, Edward M., Maistrenko, Valery N.
Published in Journal of the Chinese Chemical Society (Taipei) (01.03.2019)
Published in Journal of the Chinese Chemical Society (Taipei) (01.03.2019)
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Journal Article
Light gasoil of catalytic cracking: A quantitative description of the physical properties by joint use of chromato‐mass‐spectrometry and molecular dynamics
Ilyina, Margarita G., Khamitov, Edward M., Galiakhmetov, Rail N., Mustafin, Ildar A., Akhmetov, Arslan F., Shayakhmetova, Regina Kh, Mustafin, Akhat G.
Published in Journal of the Chinese Chemical Society (Taipei) (01.01.2020)
Published in Journal of the Chinese Chemical Society (Taipei) (01.01.2020)
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Journal Article
Synthesis of hydrated furans: Analysis of the Prins reaction mechanism
Sharipova, Gulnaz M., Gerchikov, Anatoly Ya, Safarova, Irina V., Тukhvatshin, Vadim S., Spivak, Semen I., Ilyina, Margarita G.
Published in Journal of the Chinese Chemical Society (Taipei) (01.10.2019)
Published in Journal of the Chinese Chemical Society (Taipei) (01.10.2019)
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Journal Article
Enhancing 4-propylheptane dissociation with nickel nanocluster based on molecular dynamics simulations
Ilyina, Margarita G., Khamitov, Edward M., Galiakhmetov, Rail N., Mustafin, Ildar A., Mustafin, Akhat G.
Published in Journal of molecular graphics & modelling (01.03.2017)
Published in Journal of molecular graphics & modelling (01.03.2017)
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Journal Article
Anions of uracils: N1 or N3? That is the question
Ilyina, Margarita G., Khamitov, Eduard M., Ivanov, Sergey P., Mustafin, Akhat G., Khursan, Sergey L.
Published in Computational and theoretical chemistry (15.02.2016)
Published in Computational and theoretical chemistry (15.02.2016)
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