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. Roč. 63, č. 21 (2024), č. článku e202402449. 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
Method of publishing: Open access
https://doi.org/10.1002/anie.202402449
Permanent Link: https://hdl.handle.net/11104/0353284 - 2.0581575 - ÚOCHB 2025 RIV GB eng J - Journal Article
Berešová, Marie - Bufka, Jiří - Šafařík, Martin - Bouř, Petr - Šebestík, Jaroslav
Conformations and hydration of halopropionic acids studied by molecular dynamics and Raman optical activity.
Spectrochimica Acta Part A-Molecular and Biomolecular Spectroscopy. Roč. 309, March (2024), č. článku 123852. ISSN 1386-1425. E-ISSN 1873-3557
R&D Projects: GA ČR(CZ) GA22-04669S
Research Infrastructure: e-INFRA CZ - 90140
Institutional support: RVO:61388963
Keywords : chiral halocompounds * Raman optical activity (ROA) * density functional theory (DFT) * solvation effects
OECD category: Physical chemistry
Impact factor: 4.4, year: 2022
Method of publishing: Limited access
https://doi.org/10.1016/j.saa.2024.123852
Permanent Link: https://hdl.handle.net/11104/0349676 - 3.0580544 - ÚOCHB 2025 RIV US eng J - Journal Article
Wu, Tao - Bouř, Petr - Fujisawa, T. - Unno, M.
Molecular Vibrations in Chiral Europium Complexes Revealed by Near-Infrared Raman Optical Activity.
Advanced Science. Roč. 11, č. 1 (2024), č. článku 2305521. E-ISSN 2198-3844
R&D Projects: GA ČR(CZ) GA23-05378S; GA ČR(CZ) GA22-04669S; GA MŠMT(CZ) EF18_053/0016940
Research Infrastructure: e-INFRA CZ - 90140
Institutional support: RVO:61388963
Keywords : chiral lanthanide complexes * circularly polarized luminescence * density functional theory * Raman optical activity * spectra simulations
OECD category: Physical chemistry
Impact factor: 15.1, year: 2022
Method of publishing: Open access
https://doi.org/10.1002/advs.202305521
Permanent Link: https://hdl.handle.net/11104/0349302 - 4.0576643 - FZÚ 2024 RIV GB eng J - Journal Article
Bui, Duong Thuy - Kubíčková, Lenka - Kuličková, Jarmila - Bouř, Petr - Kessler, Jiří - Řezanka, P. - Kaman, Ondřej
Gold nanoshells with magnetic cores and a urea-based receptor for SERS sensing of fluoride anions: experimental and computational study.
Analyst. Roč. 148, č. 20 (2023), s. 5070-5083. ISSN 0003-2654. E-ISSN 1364-5528
R&D Projects: GA MŠMT(CZ) EF16_019/0000760; GA MŠMT(CZ) LM2018096; GA ČR GA19-02584S; GA ČR(CZ) GA22-04669S
Grant - others:OP VVV - SOLID21(XE) CZ.02.1.01/0.0/0.0/16_019/0000760
Institutional support: RVO:68378271 ; RVO:61388963
Keywords : gold nanoshells * molecular sensor * surface-enhanced Raman spectroscopy * DFT calculations * ureas * magnetic nanoparticles
OECD category: Nano-materials (production and properties); Physical chemistry (UOCHB-X)
Impact factor: 4.2, year: 2022
Method of publishing: Open access
Permanent Link: https://hdl.handle.net/11104/0348058File Download Size Commentary Version Access 0576643.pdf 0 3.9 MB CC licence Publisher’s postprint open-access - 5.0576140 - ÚOCHB 2024 RIV DE eng J - Journal Article
Yang, Qin - Bloino, J. - Šestáková, Hana - Šebestík, Jaroslav - Kessler, Jiří - Hudecová, J. - Kapitán, J. - Bouř, Petr
Combination of Resonance and Non-Resonance Chiral Raman Scattering in a Cobalt(III) Complex.
Angewandte Chemie - International Edition. Roč. 62, č. 45 (2023), č. článku e202312521. ISSN 1433-7851. E-ISSN 1521-3773
R&D Projects: GA ČR(CZ) GA22-04669S
Institutional support: RVO:61388963
Keywords : density functional theory * metal complexes * Raman optical activity * resonance * vibronic theory
OECD category: Physical chemistry
Impact factor: 16.6, year: 2022
Method of publishing: Open access
https://doi.org/10.1002/anie.202312521
Permanent Link: https://hdl.handle.net/11104/0345732 - 6.0575450 - ÚOCHB 2024 RIV US eng J - Journal Article
Wu, Tao - Pelc, Radek - Bouř, Petr
Molecular Properties of 3d and 4fCoordination Compounds Deciphered by Raman Optical Activity Spectroscopy.
ChemPlusChem. Roč. 88, č. 9 (2023), č. článku e302300385. ISSN 2192-6506. E-ISSN 2192-6506
R&D Projects: GA ČR(CZ) GA23-05378S; GA ČR(CZ) GA22-04669S
Institutional support: RVO:61388963
Keywords : circular dichroism * circularly polarized luminescence * coordination compounds * molecular chirality * Raman optical activity
OECD category: Physical chemistry
Impact factor: 3.4, year: 2022
Method of publishing: Open access
https://doi.org/10.1002/cplu.202300385
Permanent Link: https://hdl.handle.net/11104/0345236 - 7.0573772 - ÚOCHB 2024 RIV US eng J - Journal Article
Das, Moumita - Gangopadhyay, Debraj - Hudecová, J. - Kessler, Jiří - Kapitán, J. - Bouř, Petr
Monitoring Conformation and Protonation States of Glutathione by Raman Optical Activity and Molecular Dynamics.
ChemPlusChem. Roč. 88, č. 11 (2023), č. článku e202300219. ISSN 2192-6506. E-ISSN 2192-6506
R&D Projects: GA ČR(CZ) GA22-04669S
Research Infrastructure: e-INFRA CZ II - 90254
Institutional support: RVO:61388963
Keywords : density functional theory * glutathione * molecular dynamics * Raman optical activity * spectra modeling
OECD category: Physical chemistry
Impact factor: 3.4, year: 2022
Method of publishing: Open access
https://doi.org/10.1002/cplu.202300219
Permanent Link: https://hdl.handle.net/11104/0344134 - 8.0570656 - ÚOCHB 2024 RIV GB eng J - Journal Article
Schrenková, Věra - Para Kkadan, Mohammed Siddhique - Kessler, Jiří - Kapitán, J. - Bouř, Petr
Molecular dynamics and Raman optical activity spectra reveal nucleotide conformation ratios in solution.
Physical Chemistry Chemical Physics. Roč. 25, č. 11 (2023), s. 8198-8208. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA ČR(CZ) GA22-04669S; GA MŠMT(CZ) EF16_019/0000729
Research Infrastructure: e-INFRA CZ - 90140
Institutional support: RVO:61388963
Keywords : vibrational circular dichroism * nucleic acids * free energies
OECD category: Physical chemistry
Impact factor: 3.3, year: 2022
Method of publishing: Open access
https://doi.org/10.1039/D2CP05756E
Permanent Link: https://hdl.handle.net/11104/0341979 - 9.0561951 - ÚOCHB 2023 RIV US eng J - Journal Article
Yang, Q. - Kapitán, J. - Bouř, Petr - Bloino, J.
Anharmonic Vibrational Raman Optical Activity of Methyloxirane: Theory and Experiment Pushed to the Limits.
Journal of Physical Chemistry Letters. Roč. 13, č. 38 (2022), s. 8888-8892. ISSN 1948-7185
R&D Projects: GA MŠMT(CZ) EF16_019/0000729; GA ČR(CZ) GA22-04669S
Institutional support: RVO:61388963
Keywords : circular-dichroism * spectra * spectroscopy
OECD category: Physical chemistry
Impact factor: 5.7, year: 2022
Method of publishing: Limited access
https://doi.org/10.1021/acs.jpclett.2c02320
Permanent Link: https://hdl.handle.net/11104/0334390 - 10.0561796 - ÚOCHB 2024 RIV NL eng J - Journal Article
Das, Moumita - Gangopadhyay, Debraj - Pelc, Radek - Hadravová, Romana - Šebestík, Jaroslav - Bouř, Petr
Aggregation-aided SERS: Selective detection of arsenic by surface-enhanced Raman spectroscopy facilitated by colloid cross-linking.
Talanta. Roč. 253, February (2023), č. článku 123940. ISSN 0039-9140. E-ISSN 1873-3573
R&D Projects: GA MŠMT(CZ) EF16_019/0000729; GA ČR(CZ) GA22-04669S
Institutional support: RVO:61388963
Keywords : arsenic detection * surface-enhanced Raman scattering * silver nanoparticles * colloid cross-linking
OECD category: Physical chemistry
Impact factor: 6.1, year: 2022
Method of publishing: Limited access
https://doi.org/10.1016/j.talanta.2022.123940
Permanent Link: https://hdl.handle.net/11104/0334304