Search results
- 1.0585610 - ÚOCHB 2025 RIV DE eng J - Journal Article
Halat, M. - Zajac, G. - Andrushchenko, Valery - Bouř, Petr - Baranski, R. - Pajor, K. - Baranska, M.
Induced Chirality in Canthaxanthin Aggregates Reveals Multiple Levels of Supramolecular Organization.
Angewandte Chemie - International Edition. (2024). ISSN 1433-7851. E-ISSN 1521-3773
R&D Projects: GA ČR(CZ) GA22-04669S
Research Infrastructure: e-INFRA CZ II - 90254
Institutional support: RVO:61388963
Keywords : resonance raman optical activity * circular dichroism * density functional theory * chirality induction * canthaxanthin * heparin * hyaluronic acid
Impact factor: 16.6, year: 2022
https://doi.org/10.1002/anie.202402449
Permanent Link: https://hdl.handle.net/11104/0353284 - 2.0580275 - ÚOCHB 2025 RIV GB eng J - Journal Article
Osifová, Zuzana - Kalvoda, Tadeáš - Galgonek, Jakub - Culka, Martin - Vondrášek, Jiří - Bouř, Petr - Bednárová, Lucie - Andrushchenko, Valery - Dračínský, Martin - Rulíšek, Lubomír
What are the minimal folding seeds in proteins? Experimental and theoretical assessment of secondary structure propensities of small peptide fragments.
Chemical Science. Roč. 15, č. 2 (2024), s. 594-608. ISSN 2041-6520. E-ISSN 2041-6539
R&D Projects: GA ČR(CZ) GA23-05940S; GA ČR(CZ) GA22-33060S
Research Infrastructure: e-INFRA CZ II - 90254
Institutional support: RVO:61388963
Keywords : vibrational circular-dichroism * spin coupling-constants * conformational propensities
Impact factor: 8.4, year: 2022
Method of publishing: Open access
https://doi.org/10.1039/D3SC04960D
Permanent Link: https://hdl.handle.net/11104/0349025 - 3.0561452 - ÚOCHB 2023 RIV DE eng J - Journal Article
Krupová, Monika - Leszczenko, P. - Sierka, E. - Hamplová, S. E. - Pelc, Radek - Andrushchenko, Valery
Vibrational Circular Dichroism Unravels Supramolecular Chirality and Hydration Polymorphism of Nucleoside Crystals.
Chemistry - A European Journal. Roč. 28, č. 63 (2022), č. článku e202201922. ISSN 0947-6539. E-ISSN 1521-3765
R&D Projects: GA MŠMT(CZ) EF16_019/0000729; GA ČR(CZ) GA20-10144S
Research Infrastructure: e-INFRA CZ - 90140
Institutional support: RVO:61388963
Keywords : chirality * crystal engineering * enhanced VCD * solid-state VCD * solvomorphism
OECD category: Physical chemistry
Impact factor: 4.3, year: 2022
Method of publishing: Limited access
https://doi.org/10.1002/chem.202201922
Permanent Link: https://hdl.handle.net/11104/0334068 - 4.0559924 - ÚOCHB 2023 RIV NL eng J - Journal Article
Najgebauer, P. - Staś, M. - Wrzalik, R. - Broda, M. A. - Wieczorek, P. P. - Andrushchenko, Valery - Kupka, T.
Muscimol hydration and vibrational spectroscopy - The impact of explicit and implicit water.
Journal of Molecular Liquids. Roč. 363, October (2022), č. článku 119870. ISSN 0167-7322. E-ISSN 1873-3166
R&D Projects: GA MŠMT(CZ) EF16_019/0000729
Institutional support: RVO:61388963
Keywords : molecular dynamics (MD) * muscimol * density functional theory (DFT) * tautomers * hydrogen bonds * hydration energy
OECD category: Physical chemistry
Impact factor: 6, year: 2022
Method of publishing: Open access
https://doi.org/10.1016/j.molliq.2022.119870
Permanent Link: https://hdl.handle.net/11104/0333046 - 5.0558547 - ÚOCHB 2023 RIV GB eng J - Journal Article
Kessete, J. M. - Demissie, T. B. - Chilume, M. - Mohammed, A. M. - Andrushchenko, Valery
Phosphine-borane catalysts for CO2 activation and reduction: a computational study.
Molecular Physics. Roč. 120, č. 12 (2022), č. článku e2087566. ISSN 0026-8976. E-ISSN 1362-3028
Research Infrastructure: e-INFRA CZ - 90140
Institutional support: RVO:61388963
Keywords : phosphine-borane * carbon dioxide reduction * frustrated Lewis pairs * metal-free * DFT calculations
OECD category: Physical chemistry
Impact factor: 1.7, year: 2022
Method of publishing: Limited access
https://doi.org/10.1080/00268976.2022.2087566
Permanent Link: http://hdl.handle.net/11104/0332185 - 6.0542286 - ÚOCHB 2022 RIV DE eng J - Journal Article
Lizio, M. G. - Campana, M. - De Poli, M. - Jefferies, D. F. - Cullen, W. - Andrushchenko, Valery - Chmel, N. P. - Bouř, Petr - Khalid, S. - Clayden, J. - Blanch, E. - Rodger, A. - Webb, S. J.
Insight into the Mechanism of Action and Peptide‐Membrane Interactions of Aib‐Rich Peptides: Multitechnique Experimental and Theoretical Analysis.
Chembiochem. Roč. 22, č. 9 (2021), s. 1656-1667. ISSN 1439-4227. E-ISSN 1439-7633
R&D Projects: GA MŠMT(CZ) EF16_019/0000729
Institutional support: RVO:61388963
Keywords : antimicrobial peptides * lipid-peptide interactions * membranes * molecular dynamics * peptaibols * transfer of chirality
OECD category: Biophysics
Impact factor: 3.468, year: 2021
Method of publishing: Open access
https://doi.org/10.1002/cbic.202000834
Permanent Link: http://hdl.handle.net/11104/0319731 - 7.0541262 - ÚOCHB 2022 RIV GB eng J - Journal Article
Kaminský, Jakub - Andrushchenko, Valery - Bouř, Petr
Natural and magnetic circular dichroism spectra of nucleosides: effect of the dynamics and environment.
RSC Advances. Roč. 11, č. 14 (2021), s. 8411-8419. E-ISSN 2046-2069
R&D Projects: GA ČR(CZ) GA20-10144S; GA MŠMT LTAUSA18085; GA MŠMT(CZ) EF16_019/0000729
Research Infrastructure: e-INFRA CZ - 90140
Institutional support: RVO:61388963
Keywords : nucleosides * magnetic circular dichroism * density functional theory * spectra modelling
OECD category: Physical chemistry
Impact factor: 4.036, year: 2021
Method of publishing: Open access
https://doi.org/10.1039/D1RA00076D
Permanent Link: http://hdl.handle.net/11104/0318852 - 8.0539288 - ÚOCHB 2022 RIV US eng J - Journal Article
Demissie, Taye Beyene - Shyam Sundar, Mothuku - Thangavel, Karthick - Andrushchenko, Valery - Bedekar, A. V. - Bouř, Petr
Origins of Optical Activity in an Oxo-Helicene: Experimental and Computational Studies.
ACS Omega. Roč. 6, č. 3 (2021), s. 2420-2428. ISSN 2470-1343. E-ISSN 2470-1343
R&D Projects: GA MŠMT(CZ) EF16_019/0000729; GA MŠMT(CZ) EF16_027/0008477; GA ČR(CZ) GA18-05770S
Institutional support: RVO:61388963
Keywords : helicenes * vibrational optical activity * density functional theory
OECD category: Physical chemistry
Impact factor: 4.132, year: 2021
Method of publishing: Open access
https://doi.org/10.1021/acsomega.0c06079
Permanent Link: http://hdl.handle.net/11104/0317238 - 9.0521525 - ÚOCHB 2021 RIV GB eng J - Journal Article
Kovač, Ishak - Jakl, M. - Fanfrlík, Jindřich - Andrushchenko, Valery - Jaklová Dytrtová, Jana
Complexation and stability of the fungicide penconazole in the presence of zinc and copper ions.
Rapid Communications in Mass Spectrometry. Roč. 34, č. 9 (2020), č. článku e8714. ISSN 0951-4198. E-ISSN 1097-0231
R&D Projects: GA ČR(CZ) GA18-01710S
Institutional support: RVO:61388963
Keywords : triazoles * zinc * copper * ESI-MS * DFT calculations
OECD category: Physical chemistry
Impact factor: 2.419, year: 2020
Method of publishing: Limited access
https://onlinelibrary.wiley.com/doi/full/10.1002/rcm.8714
Permanent Link: http://hdl.handle.net/11104/0306123 - 10.0517401 - ÚOCHB 2020 RIV CH eng J - Journal Article
Westphal, K. R. - Werner, M. I. H. - Nielsen, K. A. H. - Sorensen, J. L. - Andrushchenko, Valery - Winde, J. - Hertz, M. - Jensen, M. A. - Mortensen, M. L. - Bouř, Petr - Sondergaard, T. E. - Wimmer, R.
Characterization of Eight Novel Spiroleptosphols from Fusarium avenaceum.
Molecules. Roč. 24, č. 19 (2019), č. článku 3498. E-ISSN 1420-3049
R&D Projects: GA MŠMT(CZ) LTC17012; GA MŠMT(CZ) EF16_019/0000729
Institutional support: RVO:61388963
Keywords : spiroleptosphol * secondary metabolites * polyketides * polyketide synthases * PKS * Fusarium avenaceum
OECD category: Analytical chemistry
Impact factor: 3.267, year: 2019
Method of publishing: Open access
https://www.mdpi.com/1420-3049/24/19/3498
Permanent Link: http://hdl.handle.net/11104/0302996