Search results
- 1.0498255 - ÚOCHB 2019 CZ eng A - Abstract
Socha, Ondřej - Hodgkinson, P. - Widdifield, C. M. - Yates, J. R. - Dračínský, Martin
Exploring Systematic Discrepancies in DFT Calculations of Chlorine Nuclear Quadrupole Couplings.
33rd NMR Valtice. Central European NMR Meeting. Brno: Tribun EU, 2018 - (Novotný, J.; Marek, R.). C8. ISBN 978-80-263-1400-4.
[NMR Valtice. Central European NMR Meeting /33./. 23.04.2018-25.04.2018, Valtice]
R&D Projects: GA ČR GA15-11223S
Institutional support: RVO:61388963
Keywords : NMR spectroscopy * DFT calculations * quadrupolar coupling
OECD category: Physical chemistry
Permanent Link: http://hdl.handle.net/11104/0291137 - 2.0484079 - ÚOCHB 2018 AU eng A - Abstract
Procházková, Eliška - Čechová, Lucie - Kind, J. - Thiele, C. M. - Janeba, Zlatko - Dračínský, Martin
Photoswitchable intramolecular hydrogen bonds in 5-phenylazopyrimidines revealed by NMR spectroscopy with in situ irradiation.
ANZMAG 2017. The 11th Australian and New Zealand Society for Magnetic Resonance Conference. Kingscliff: ANZMAG, 2017. s. 53-54.
[ANZMAG 2017. Australian and New Zealand Society for Magnetic Resonance Conference /11./. 02.12.2017-06.12.2017, Kingscliff]
R&D Projects: GA ČR GA15-11223S
Institutional support: RVO:61388963
Keywords : in situ irradiation NMR * hydrogen bonds
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0279506 - 3.0481191 - ÚOCHB 2018 CZ eng A - Abstract
Čechová, Lucie - Procházková, Eliška - Kind, J. - Bártová, Kateřina - Thiele, C. M. - Dračínský, Martin - Janeba, Zlatko
5-Azopyrimidines: Synthesis and NMR study of their photochemical behavior.
SCNAC 2017. 17th Symposium on Chemistry of Nucleic Acid Components. Praha: Confis Conference, 2017. s. 127.
[SCNAC 2017. Symposium on Chemistry of Nucleic Acid Components /17./. 04.06.2017-09.06.2017, Český Krumlov]
R&D Projects: GA ČR GA15-11223S
Institutional support: RVO:61388963
Keywords : 5-azopyrimidines * NMR
Subject RIV: CC - Organic Chemistry
Permanent Link: http://hdl.handle.net/11104/0276790 - 4.0479561 - ÚOCHB 2018 FR eng A - Abstract
Dračínský, Martin - Kaleta, Jiří - Bastien, Guillaume - Michl, Josef - Feringa, B.
Molecular rotors and motors studied by solid-state NMR spectroscopy.
A European Conference on Solid State Nuclear Magnetic Resonance. Chamonix Mont-Blanc: International Society of Magnetic Resonance, 2017. R 27.
[Alpine Conference on Solid-State NMR /10./. 10.09.2017-14.09.2017, Chamonix Mont-Blanc]
R&D Projects: GA ČR GA15-11223S
Institutional support: RVO:61388963
Keywords : molecular rotors * NMR spectroscopy
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0275564 - 5.0476605 - ÚOCHB 2018 PL eng A - Abstract
Dračínský, Martin - Kaleta, Jiří - Bastien, Guillaume - Michl, Josef - Feringa, B.
Molecular rotors and motors studied by solid-state NMR spectroscopy.
EUROMAR 2017. Warsaw: University of Warsaw, 2017. s. 392.
[EUROMAR 2017. 02.07.2017-06.07.2017, Warsaw]
R&D Projects: GA ČR GA15-11223S
Institutional support: RVO:61388963
Keywords : NMR spectroscopy * molecular motors * host-guest interactions
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0273075 - 6.0476604 - ÚOCHB 2018 PL eng A - Abstract
Pohl, Radek - Dračínský, Martin
Tautomerism of nucleobases studied by low-temperature solution NMR.
EUROMAR 2017. Warsaw: University of Warsaw, 2017. s. 306.
[EUROMAR 2017. 02.07.2017-06.07.2017, Warsaw]
R&D Projects: GA ČR GA15-11223S
Institutional support: RVO:61388963
Keywords : NMR spectroscopy * hydrogen bonding * tautomer equilibria
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0273073 - 7.0476603 - ÚOCHB 2018 PL eng A - Abstract
Bártová, Kateřina - Čechová, Lucie - Janeba, Zlatko - Dračínský, Martin
Conformational equilibria controlled by intermolecular interactions.
EUROMAR 2017. Warsaw: University of Warsaw, 2017. s. 263.
[EUROMAR 2017. 02.07.2017-06.07.2017, Warsaw]
R&D Projects: GA ČR GA15-11223S
Institutional support: RVO:61388963
Keywords : NMR spectroscopy * hydrogen bonding * conformational equilibria
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0273072 - 8.0476600 - ÚOCHB 2018 PL eng A - Abstract
Socha, Ondřej - Hodgkinson, P. - Widdifield, C. M. - Yates, J. R. - Dračínský, Martin
Exploring systematic discrepancies in DFT calculations of chlorine nuclear quadrupole couplings.
EUROMAR 2017. Warsaw: University of Warsaw, 2017. s. 135.
[EUROMAR 2017. 02.07.2017-06.07.2017, Warsaw]
R&D Projects: GA ČR GA15-11223S
Institutional support: RVO:61388963
Keywords : NMR spectroscopy * DFT calculations * quadrupolar coupling
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0273071 - 9.0476408 - ÚOCHB 2018 CZ eng A - Abstract
Dračínský, Martin - Čechová, Lucie - Janeba, Zlatko - Procházková, Eliška - Hodgkinson, P.
Resonance-assisted stabilisation of hydrogen bonds probed by NMR spectroscopy and path integral molecular dynamics.
32nd NMR Valtice. Central European NMR Meeting. Valtice: Stuare, 2017 - (Novotný, J.; Marek, R.). C29. ISBN 978-80-86441-49-8.
[NMR Valtice. Central European NMR Meeting /32./. 23.04.2017-26.04.2017, Valtice]
R&D Projects: GA ČR GA15-11223S
Institutional support: RVO:61388963
Keywords : NMR spectroscopy * DFT calculations * pyrimidines
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0272916 - 10.0476305 - ÚOCHB 2018 HU eng A - Abstract
Tarábek, Ján - Procházková, Eliška - Čechová, Lucie - Janeba, Zlatko - Dračínský, Martin
Electron density "PUSH-PULL" interaction in series of 5-nitrosopyrimidines studied by NMR/EPR/DFT.
Magnetic Moments in Central Europe 2017. Budapest: Diamond Congress, 2017 - (Szántay, Jr., C.). s. 110. ISBN 978-615-5270-32-1.
[Magnetic Moments in Central Europe 2017. 08.03.2017-12.03.2017, Budapest]
R&D Projects: GA ČR GA15-11223S
Institutional support: RVO:61388963
Keywords : NMR spectroscopy * EPR spectroscopy * electrochemistry
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0272832