Oxyphor 2P: A High-Performance Probe for Deep-Tissue Longitudinal Oxygen Imaging
Esipova, Tatiana V., Barrett, Matthew J.P., Erlebach, Eva, Masunov, Artëm E., Weber, Bruno, Vinogradov, Sergei A.
Published in Cell metabolism (05.03.2019)
Published in Cell metabolism (05.03.2019)
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Journal Article
Covalent Organic Frameworks in Computational Design of Second-Harmonic Generation Materials: Role of Tetrel Atoms and Their Interactions
Yushina, Irina D., Masunov, Artëm E., Bartashevich, Ekaterina V.
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (26.09.2024)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (26.09.2024)
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Journal Article
Shock Tube/Laser Absorption and Kinetic Modeling Study of Triethyl Phosphate Combustion
Neupane, Sneha, Barnes, Frank, Barak, Samuel, Ninnemann, Erik, Loparo, Zachary, Masunov, Artëm E, Vasu, Subith S
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (19.04.2018)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (19.04.2018)
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Journal Article
Chemical Reaction CO+OH• → CO2+H• Autocatalyzed by Carbon Dioxide: Quantum Chemical Study of the Potential Energy Surfaces
Masunov, Artëm E., Wait, Elizabeth, Vasu, Subith S.
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (04.08.2016)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (04.08.2016)
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Journal Article
Electronic Hyperpolarizabilities for Donor−Acceptor Molecules with Long Conjugated Bridges: Calculations versus Experiment
Suponitsky, Kyrill Yu, Liao, Yi, Masunov, Artëm E
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (15.10.2009)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (15.10.2009)
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Journal Article
Pseudocyclic Form of 4‑Hydroxypyrrolidine-2-carboxanilide Podands with Trioxyethylene Chain: Modeling, Conformational Search, and NMR Analysis
Borodina, Olga, Ovchinnikova, Irina, Makarov, Gennady, Yeltsov, Oleg, Titova, Yulia, Fedorova, Olga, Masunov, Artëm E, Bartashevich, Ekaterina
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (22.07.2021)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (22.07.2021)
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Journal Article
Theoretical Calculation of Reaction Rates and Combustion Kinetic Modeling Study of Triethyl Phosphate (TEP)
Neupane, Sneha, Rahman, Ramees K, Masunov, Artëm E, Vasu, Subith S
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (06.06.2019)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (06.06.2019)
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Journal Article
Two-Photon Absorbing Phosphorescent Metalloporphyrins: Effects of π‑Extension and Peripheral Substitution
Esipova, Tatiana V, Rivera-Jacquez, Héctor J, Weber, Bruno, Masunov, Artëm E, Vinogradov, Sergei A
Published in Journal of the American Chemical Society (07.12.2016)
Published in Journal of the American Chemical Society (07.12.2016)
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Journal Article
Three-Photon Spectroscopy of Porphyrins
Ravotto, Luca, Meloni, Stephen L, Esipova, Tatiana V, Masunov, Artëm E, Anna, Jessica M, Vinogradov, Sergei A
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (31.12.2020)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (31.12.2020)
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Journal Article
How Many Isomers Do Metallic Clusters Have? Case of Magnesium Clusters of up to 55 Atoms
Ignatov, Stanislav K, Belyaev, Sergey N, Panteleev, Sergey V, Masunov, Artëm E
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (05.08.2021)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (05.08.2021)
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Journal Article
Global Structure Optimization of Pt Clusters Based on the Modified Empirical Potentials, Calibrated using Density Functional Theory
Ignatov, Stanislav K, Razuvaev, Alexey G, Loginova, Anastasiia S, Masunov, Artëm E
Published in Journal of physical chemistry. C (27.11.2019)
Published in Journal of physical chemistry. C (27.11.2019)
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Journal Article
Symmetry-Breaking in Cationic Polymethine Dyes: Part 2. Shape of Electronic Absorption Bands Explained by the Thermal Fluctuations of the Solvent Reaction Field
Masunov, Artëm E, Anderson, Dane, Freidzon, Alexandra Ya, Bagaturyants, Alexander A
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (02.07.2015)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (02.07.2015)
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Journal Article
Atomistic mechanism of polyphenol amyloid aggregation inhibitors: molecular dynamics study of Curcumin, Exifone, and Myricetin interaction with the segment of tau peptide oligomer
Berhanu, Workalemahu M., Masunov, Artëm E.
Published in Journal of biomolecular structure & dynamics (03.07.2015)
Published in Journal of biomolecular structure & dynamics (03.07.2015)
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Journal Article
Quantum Chemical Study of CH3 + O2 Combustion Reaction System: Catalytic Effects of Additional CO2 Molecule
Masunov, Artëm E, Wait, Elizabeth, Vasu, Subith S
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (03.08.2017)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (03.08.2017)
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Journal Article
Prediction of Crystal Structures and Mechanical Properties for Brittle, Plastic, and Elastic Polymorphs of 4‑Bromophenyl 4‑Bromobenzoate
Masunov, Artëm E., Wiratmo, Meryl, Dyakov, Alexander A., Matveychuk, Yury V., Bartashevich, Ekaterina V.
Published in Crystal growth & design (06.07.2022)
Published in Crystal growth & design (06.07.2022)
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Journal Article