Search results
- 1.0585706 - 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/11104/0353409 - 2.0585703 - 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 - 3.0585038 - 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 - 4.0584490 - 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 - 5.0584468 - 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 - 6.0583260 - 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 - 7.0583095 - 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 - 8.0583050 - ÚCHP 2024 CZ eng A - Abstract
Michálková, Lenka - Horník, Štěpán - Sýkora, J. - Bunganič, B.
Prediction of Pathologic Change Development in the Pancreas Associated with Diabetes Mellitus Assessed by NMR Metabolomics.
Abstracts Posters. Prague: NMR Spectroscopy Research Service Group, 2023. s. 37, č. článku P26..
[The Central European NMR Symposium & Bruker Users Meeting CEUM 20232023. 13.09.2023-15.09.2023, Prague]
Institutional support: RVO:67985858
Keywords : pancreatic cancer * diabetes mellitus * NMR metabolomics
OECD category: Analytical chemistry
Permanent Link: https://hdl.handle.net/11104/0351046File Download Size Commentary Version Access SKMBT_C22024022110411.pdf 0 941.3 KB Publisher’s postprint open-access - 9.0583047 - ÚCHP 2024 CZ eng A - Abstract
Horník, Štěpán - Pokorná, Petra - Vodička, Petr - Schwarz, Jaroslav - Ždímal, Vladimír - Sýkora, J.
A source apportionment of rural atmospheric aerosol using NMR aerosolomics.
Abstracts Posters. Prague: NMR Spectroscopy Research Service Group, 2023. s. 34, č. článku P17..
[The Central European NMR Symposium & Bruker Users Meeting CEUM 20232023. 13.09.2023-15.09.2023, Prague]
Institutional support: RVO:67985858
Keywords : NMR aerosolomics * source apportionment * atmospheric aerosols
OECD category: Meteorology and atmospheric sciences
Permanent Link: https://hdl.handle.net/11104/0351043File Download Size Commentary Version Access SKMBT_C22024022110410.pdf 0 955.4 KB Publisher’s postprint open-access - 10.0581740 - BFÚ 2024 RIV NL eng J - Journal Article
Dzurov, M. - Pospíšilová, S. - Krafčíková, Michaela - Trantírek, L. - Vojtová, L. - Ryneš, J.
A thermosensitive gel matrix for bioreactor-assisted in-cell NMR of nucleic acids and proteins.
Journal of Biomolecular NMR. Roč. 77, č. 5-6 (2023), s. 203-215. ISSN 0925-2738. E-ISSN 1573-5001
R&D Projects: GA MŠMT EF15_003/0000477
Institutional support: RVO:68081707
Keywords : peg-plga copolymer * drug-delivery * hydrogels * spectroscopy * stability * agarose * dna * pla-peg-pla * Thermosensitive hydrogel * Cell immobilization * Bioreactor * In-cell NMR
OECD category: Biochemistry and molecular biology
Impact factor: 2.7, year: 2022
Method of publishing: Open access
https://link.springer.com/article/10.1007/s10858-023-00422-7
Permanent Link: https://hdl.handle.net/11104/0350097