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ORCIDElena Yu. Tupikina
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Journal Articles
- 2024
[j6]Daniil A. Shitov, Danil V. Krutin, Elena Yu. Tupikina
:
Mutual influence of non-covalent interactions formed by imidazole: A systematic quantum-chemical study. J. Comput. Chem. 45(13): 1046-1060 (2024)- 2021
- [j5]Elena Yu. Tupikina, Peter M. Tolstoy, Anna A. Titova, Mikhail A. Kostin, Gleb S. Denisov:
Estimations of FH···X hydrogen bond energies from IR intensities: Iogansen's rule revisited. J. Comput. Chem. 42(8): 564-571 (2021) - [j4]Valerii V. Karpov, Aleksandra M. Puzyk, Peter M. Tolstoy, Elena Yu. Tupikina:
Hydration of selenolate moiety: Ab initio investigation of properties of O-H⋯Se(-) hydrogen bonds in CH3Se(-)⋯(H2O)n clusters. J. Comput. Chem. 42(28): 2014-2023 (2021) - 2020
- [j3]Elena Yu. Tupikina, Konstantin G. Tokhadze, Gleb S. Denisov, Peter M. Tolstoy:
Lone pairs mapping by Laplacian of 3He NMR chemical shift. J. Comput. Chem. 41(12): 1194-1199 (2020) - 2019
- [j2]Elena Yu. Tupikina, Gleb S. Denisov, Peter M. Tolstoy:
Anticooperativity of FH···Cl- hydrogen bonds in [FH)nCl]- clusters (n = 1...6). J. Comput. Chem. 40(32): 2858-2867 (2019) - 2018
- [j1]Elena Yu. Tupikina, Alexandra A. Efimova, Gleb S. Denisov, Peter M. Tolstoy:
Outer electronic shell visualization by NMR chemical shift laplacian of a helium probe. J. Comput. Chem. 39(29): 2459-2462 (2018)
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