Search results
- 1.0586876 - ÚOCHB 2025 RIV DE eng J - Journal Article
Svítok, A. - Blahut, Jan - Urbanovský, P. - Hermann, P.
Dynamics of Coordinated Phosphonate Group Directly Observed by 17O-NMR in Lanthanide(III) Complexes of a Mono(ethyl phosphonate) DOTA Analogue.
Chemistry - A European Journal. (2024). ISSN 0947-6539. E-ISSN 1521-3765
Research Infrastructure: e-INFRA CZ II - 90254
Institutional support: RVO:61388963
Keywords : paramagnetic NMR * solution dynamics * macrocycle complexes * isomerism and chirality * DFT calculations
Impact factor: 4.3, year: 2022
Method of publishing: Open access
https://doi.org/10.1002/chem.202400970
Permanent Link: https://hdl.handle.net/11104/0354250 - 2.0586430 - ÚTAM 2025 RIV NL eng J - Journal Article
Sotiriadis, Konstantinos - Mazur, A. - Tolstoy, P. M. - Mácová, Petra - Viani, A.
External magnesium sulfate attack on hydrated Portland-limestone cements: Effect of the concurrent presence of sodium chloride in the corrosive environment and metakaolin admixture in the binder.
Cement and Concrete Composites. Roč. 151, August (2024), č. článku 105614. ISSN 0958-9465. E-ISSN 1873-393X
R&D Projects: GA ČR(CZ) GC21-35772J
Institutional support: RVO:68378297
Keywords : Portland-limestone cement * thaumasite sulfate attack * chlorides * metakaolin * solid-state NMR spectroscopy
OECD category: Materials engineering
Impact factor: 10.5, year: 2022
Method of publishing: Limited access
https://doi.org/10.1016/j.cemconcomp.2024.105614
Permanent Link: https://hdl.handle.net/11104/0353957 - 3.0586218 - ÚOCHB 2025 RIV US eng J - Journal Article
Osifová, Zuzana - Socha, Ondřej - Dračínský, Martin
NMR-Challenge.com: Exploring the Most Common Mistakes in NMR Assignments.
Journal of Chemical Education. Roč. 101, č. 6 (2024), s. 2561-2569. ISSN 0021-9584. E-ISSN 1938-1328
R&D Projects: GA ČR(CZ) GA22-15374S
Institutional support: RVO:61388963
Keywords : second-year undergraduate * organic chemistry * computer-based learning * distance learning/self instruction * NMR spectroscopy
Impact factor: 3, year: 2022
Method of publishing: Open access
https://doi.org/10.1021/acs.jchemed.4c00092
Permanent Link: https://hdl.handle.net/11104/0353797 - 4.0585706 - ÚOCHB 2025 RIV NL eng J - Journal Article
Chaloupecká, Ema - Kurfiřt, Martin - Červenková Šťastná, Lucie - Karban, Jindřich - Dračínský, Martin
Exploring long-range fluorine-carbon J-coupling for conformational analysis of deoxyfluorinated disaccharides: A combined computational and NMR study.
Bioorganic Chemistry. Roč. 147, June (2024), č. článku 107388. ISSN 0045-2068. E-ISSN 1090-2120
R&D Projects: GA ČR(CZ) GA23-05146S
Institutional support: RVO:61388963 ; RVO:67985858
Keywords : saccharides * NMR spectroscopy * conformation * DFT calculations * fluorine
OECD category: Organic chemistry (UCHP-M)
Impact factor: 5.1, year: 2022
Method of publishing: Limited access
https://doi.org/10.1016/j.bioorg.2024.107388
Permanent Link: https://hdl.handle.net/11104/0353409File Download Size Commentary Version Access 1-s2.0-S0045206824002931-main.pdf 0 3.6 MB Publisher’s postprint require - 5.0585703 - FZÚ 2025 RIV GB eng J - Journal Article
Harmošová, M. - Vilková, M. - Kello, M. - Šebová, D. - Samoľová, Erika - Litecká, Miroslava - Potočňák, I.
Low-dimensional compounds containing bioactive ligands. Part XXIII: A comprehensive study of the preparation and cytotoxic activities of zirconium(IV) complexes with 8-hydroxyquinoline and its derivatives.
Polyhedron. Roč. 249, Feb (2024), č. článku 116794. ISSN 0277-5387. E-ISSN 1873-3719
R&D Projects: GA MŠMT LM2023065
Institutional support: RVO:68378271 ; RVO:61388980
Keywords : crystal structure * NMR spectroscopy * synthesis * cytotoxicity * Zr complexes * 8-hydroxyquinoline derivatives
OECD category: Condensed matter physics (including formerly solid state physics, supercond.); Inorganic and nuclear chemistry (UACH-T)
Impact factor: 2.6, year: 2022
Permanent Link: https://hdl.handle.net/11104/0353405 - 6.0585038 - ÚCHP 2025 CZ eng D - Thesis
Michálková, Lenka
Application of nuclear magnetic resonance spectroscopy in clinical diagnosis.
Ústav chemických procesů AV ČR, v. v. i. Defended: Praha. 26.06.2023. - Praha, 2023. 148 s.
Institutional support: RVO:67985858
Keywords : nuclear magnetic resonance (NMR( * pancreatic cancer * clinical diagnostic
OECD category: Analytical chemistry
Permanent Link: https://hdl.handle.net/11104/0352806 - 7.0584490 - ÚOCHB 2025 RIV DE eng J - Journal Article
Manna, Debashree - Lo, Rabindranath - Vacek, Jaroslav - Miriyala, Vijay Madhav - Bouř, Petr - Wu, Tao - Osifová, Zuzana - Nachtigallová, Dana - Dračínský, Martin - Hobza, Pavel
The Stability of Hydrogen-Bonded Ion-Pair Complex Unexpectedly Increases with Increasing Solvent Polarity.
Angewandte Chemie - International Edition. Roč. 63, č. 20 (2024), č. článku e202403218. ISSN 1433-7851. E-ISSN 1521-3773
R&D Projects: GA ČR(CZ) GA22-15374S
Institutional support: RVO:61388963
Keywords : hydrogen bonding * solvent effect * NMR * micro-solvation * slow-growth dynamics
Impact factor: 16.6, year: 2022
Method of publishing: Open access
https://doi.org/10.1002/anie.202403218
Permanent Link: https://hdl.handle.net/11104/0352407 - 8.0584468 - ÚOCHB 2025 RIV GB eng J - Journal Article
Chaloupecká, Ema - Tyrpekl, V. - Bártová, Kateřina - Nishiyama, Y. - Dračínský, Martin
NMR crystallography of amino acids.
Solid State Nuclear Magnetic Resonance. Roč. 130, April (2024), s. 101921. ISSN 0926-2040. E-ISSN 1527-3326
R&D Projects: GA ČR(CZ) GA22-15374S
Institutional support: RVO:61388963
Keywords : solid-state NMR spectroscopy * DFT calculations * amino acids * polymorphism * disorder
Impact factor: 3.2, year: 2022
Method of publishing: Limited access
https://doi.org/10.1016/j.ssnmr.2024.101921
Permanent Link: https://hdl.handle.net/11104/0352378 - 9.0583260 - BFÚ 2024 RIV US eng J - Journal Article
Mlýnský, Vojtech - Kührová, Petra - Stadlbauer, Petr - Krepl, Miroslav - Otyepka, M. - Banáš, Pavel - Šponer, Jiří
Simple Adjustment of Intranucleotide Base-Phosphate Interaction in the OL3 AMBER Force Field Improves RNA Simulations.
Journal of Chemical Theory and Computation. Roč. 19, č. 22 (2023), s. 8423-8433. ISSN 1549-9618. E-ISSN 1549-9626
R&D Projects: GA ČR(CZ) GA23-05639S
Institutional support: RVO:68081707
Keywords : molecular-dynamics simulations * replica exchange * parameters * tetraloops * uucg * nmr * resolution
OECD category: Atomic, molecular and chemical physics (physics of atoms and molecules including collision, interaction with radiation, magnetic resonances, Mössbauer effect)
Impact factor: 5.5, year: 2022
Method of publishing: Open access
https://pubs.acs.org/doi/10.1021/acs.jctc.3c00990
Permanent Link: https://hdl.handle.net/11104/0351262 - 10.0583095 - ÚOCHB 2025 RIV US eng J - Journal Article
Štěpánová, Sille - Andris, Erik - Gutten, Ondrej - Buděšínský, Miloš - Dejmek, Milan - Břehová, Petra - Rulíšek, Lubomír - Kašička, Václav
Acidity constants and protonation sites of cyclic dinucleotides determined by capillary electrophoresis, quantum chemical calculations, and NMR spectroscopy.
Electrophoresis. Roč. 45, 7/8 (2024), s. 687-705. ISSN 0173-0835. E-ISSN 1522-2683
R&D Projects: GA ČR(CZ) GA20-03899S; GA ČR(CZ) GA23-05940S
Institutional support: RVO:61388963
Keywords : acidity constant * capillary electrophoresis * cyclic dinucleotides * DFT calculations * NMR spectroscopy
Impact factor: 2.9, year: 2022
Method of publishing: Open access
https://doi.org/10.1002/elps.202300232
Permanent Link: https://hdl.handle.net/11104/0351092