Search results
- 1.0360516 - ÚOCHB 2012 US eng A - Abstract
Yamamoto, Shigeki - Straka, Michal - Watarai, H. - Bouř, Petr
Analysis of Solution Structure of Valinomycin Studied by Raman Optical Activity.
I2nd International Conference on Vibrational Optical Activity (VOA) and Bio-Medical Applications of Raman Spectroscopy. Albany: -, 2010. s. 17-17.
[International Conference on Vibrational Optical Activity (VOA) and Bio-Medical Applications of Raman Spectroscopy /2./. 05.08.2010-07.08.2010, Albany]
R&D Projects: GA AV ČR IAA400550702; GA ČR GA203/09/2037
Grant - others:AV ČR(CZ) M200550902
Institutional research plan: CEZ:AV0Z40550506
Keywords : raman optical activity * valinomycin
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0198039 - 2.0356440 - ÚOCHB 2011 CZ eng A - Abstract
Andrushchenko, Valery - Tsankov, D. - Krasteva, M. - Wieser, H. - Bouř, Petr
Structure of guanine ostamers d(G)8 determined by combination of VCD spectroscopy and theoretical computations.
Materials Structure in Chemistry, Biology, Physics and Technology. Czech and Slovak Crystallographic Association. Roč. 17, 1a (2010), b6-b7. ISSN 1211-5894.
[Discussions in Structural Molecular Biology /8./. 18.03.2010-20.3.2010, Nové Hrady]
R&D Projects: GA ČR GAP208/10/0559; GA AV ČR IAA400550702
Grant - others:AV ČR(CZ) M200550902
Institutional research plan: CEZ:AV0Z40550506
Keywords : VCD * IR spectroscopy * vibrational circular dichroism
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0194961 - 3.0352617 - ÚOCHB 2011 CZ cze A - Abstract
Raich, I. - Tomčáková, K. - Kaminský, Jakub
Predikce chiroptických a spektrálních vlastností monosacharidů.
[Prediction of chiroptical and spectral properties of monosacharides.]
Chemické listy. Česká společnost chemická. Roč. 104, č. 11 (2010), s. 1122-1123. ISSN 0009-2770. E-ISSN 1213-7103.
[Pokroky v organické, bioorganické a farmaceutické chemii /45./. 20.11.2010-22.11.2010, Nymburk]
R&D Projects: GA AV ČR IAA400550702
Institutional research plan: CEZ:AV0Z40550506
Keywords : DFT * NMR
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0192088 - 4.0348829 - ÚOCHB 2011 CZ eng A - Abstract
Hrudíková, Jana - Kapitán, Josef - Baumruk, V. - Bouř, Petr
Raman and Raman Optical Activity Conformational Study of a Cyclic Hexapeptide.
Materials Structure in Chemistry, Biology, Physics and Technology. Czech and Slovak Crystallographic Association. Roč. 17, 1a (2010), b37-b37. ISSN 1211-5894
R&D Projects: GA ČR GA203/06/0420; GA AV ČR IAA400550702
Institutional research plan: CEZ:AV0Z40550506
Keywords : raman optical activity * simulations * spectral averaging
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0189249 - 5.0348808 - ÚOCHB 2011 US eng A - Abstract
Hudecová, Jana - Kapitán, Josef - Baumruk, V. - Bouř, Petr
Flexibility of a Model Cyclic Hexapeptide Studied by the Raman and Raman Optical Activity.
2nd International Conference on Vibrational Optical Activity (VOA-2) and Bio-Medical Applications of Raman Spectroscopy (BMARS). Albany, New York: University at Albany, State University of New York, 2010. s. 4-4.
[International Conference on Vibrational Optical Activity (VOA-2) and Bio-Medical Applications of Raman Spectroscopy (BMARS) /2./. 05.08.2010-07.08.2010, Albany, New York]
R&D Projects: GA ČR GA203/06/0420; GA AV ČR IAA400550702
Grant - others:GA UK(CZ) 126310
Institutional research plan: CEZ:AV0Z40550506
Keywords : raman optical activity * spectral averaging * (DFT) simulations
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0189234 - 6.0348795 - ÚOCHB 2011 IT eng A - Abstract
Hudecová, Jana - Kapitán, Josef - Baumruk, V. - Bouř, Petr
Flexibility of a Model Cyclic Hexapeptide Studied by the Raman and Raman Optical Activity.
EUCMOS 2010. 30th European Congress on Molecular Spectroscopy. Florence: -, 2010 - (Becucci, M.; Gellini, C.; Schettino, V.). s. 143-143
[EUCMOS 2010. European Congress on Molecular Spectroscopy /30./. 29.08.2010-03.09.2010, Florence]
R&D Projects: GA ČR GA203/06/0420; GA AV ČR IAA400550702
Grant - others:GA UK(CZ) 126310
Institutional research plan: CEZ:AV0Z40550506
Keywords : raman optical activity * spectral averaging * (DFT) simulations
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0189224 - 7.0346815 - ÚOCHB 2011 PL eng A - Abstract
Andrushchenko, Valery - Wieser, H. - Bouř, Petr
Simulations of nucleic acid vibrational spectra.
Modeling &Design of Molecular Materials 2010. Wroclaw: Wroclaw University of Technology, 2010. L24-L24.
[Modeling & Design of Molecular Materials 2010. 04.07.2010-08.07.2010, Wroclaw]
R&D Projects: GA ČR GAP208/10/0559; GA AV ČR IAA400550702
Institutional research plan: CEZ:AV0Z40550506
Keywords : nucleic acid * IR * VCD
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0187739 - 8.0338193 - ÚOCHB 2010 CZ cze A - Abstract
Raich, I. - Tomčáková, K. - Kaminský, Jakub
Predikce chiroptických a spektrálních vlastností monosacharidů.
[Prediction of chiroptical and spectral properties of monosaccharides.]
Chemické listy. Česká společnost chemická. Roč. 103, č. 11 (2009), s. 995-995. ISSN 0009-2770. E-ISSN 1213-7103.
[Pokroky v organické, bioorganické a farmaceutické chemii /44./. 27.11.2009-29.11.2009, Liblice]
R&D Projects: GA AV ČR IAA400550702
Institutional research plan: CEZ:AV0Z40550506
Keywords : optical rotation * infrared spectroscopy * NMR
Subject RIV: CC - Organic Chemistry
Permanent Link: http://hdl.handle.net/11104/0182033 - 9.0313324 - ÚOCHB 2009 CZ eng A - Abstract
Sychrovský, Vladimír - Benda, Ladislav - Prokop, Zdeněk - Blechta, Vratislav - Schraml, Jan - Špirko, Vladimír
Probing the flexibility of internal rotation in silylated phenols with the NMR scalar coupling constants.
[Měření flexibility vnitřní rotace v silylovaných fenylech pomocí NMR skalárních štěpicích konstant.]
23rd NMR Valtice. Central European NMR Meeting. Brno: -, 2008 - (Radek, M.). C29-C29. ISBN 978-80-86441-39-9.
[Central European NMR Meeting. NMR Valtice /23./. 20.04.2008-23.04.2008, Valtice]
R&D Projects: GA AV ČR IAA400550701; GA AV ČR IAA400550702; GA AV ČR IAA400720706; GA ČR GA203/06/0738; GA MŠMT LC512
Institutional research plan: CEZ:AV0Z40550506; CEZ:AV0Z40720504
Keywords : flexibility * internal rotation * scalar coupling
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0164180 - 10.0312992 - ÚOCHB 2009 AU eng A - Abstract
Kaminský, Jakub - Kapitán, Josef - Bouř, Petr
Interpretation of Raman and Raman optical activity spectra of flexible acyclic sugar derivatives.
[Interpretace Ramanových a ROA spekter flexibilních acyklických cukerných derivátů.]
Proceedings of the Eighth Triennial Congress of the World Association of the Theoretical and Computational Chemists. Sydney: World Association of Theoretical and Computational Chemists, 2008 - (Jordan, M.). s. 185-185. ISBN 978-0-646-50151-2.
[WATOC 08. Congress of the World Association of Theoretical and Computational Chemists /8./. 14.09.2008-19..09.2008, Sydney]
R&D Projects: GA ČR GA203/06/0420; GA ČR GA202/07/0732; GA AV ČR IAA400550702
Institutional research plan: CEZ:AV0Z40550506
Keywords : ROA spectroscopy * DFT * MD
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0163924