Search results

  1. 1.
    0546945 - ÚMCH 2022 RIV CH eng J - Journal Article
    Czernek, Jiří - Brus, Jiří
    Modeling the structure of crystalline alamethicin and its NMR chemical shift tensors.
    Antibiotics (Basel). Roč. 10, č. 10 (2021), s. 1-12, č. článku 1265. ISSN 2079-6382. E-ISSN 2079-6382
    R&D Projects: GA MŠk(CZ) LTAUSA18011
    Grant - others:AV ČR(CZ) StrategieAV21/10
    Program:StrategieAV
    Research Infrastructure: e-INFRA CZ - 90140; ELIXIR-CZ - 90047
    Institutional support: RVO:61389013
    Keywords : antimicrobial peptides * alamethicin * solid-state NMR
    Subject RIV: CF - Physical ; Theoretical Chemistry
    OBOR OECD: Physical chemistry
    Impact factor: 4.639, year: 2020
    Method of publishing: Open access
    https://www.mdpi.com/2079-6382/10/10/1265
    Permanent Link: http://hdl.handle.net/11104/0323867
     
     
  2. 2.
    0545620 - ÚMCH 2022 RIV CH eng J - Journal Article
    Muselík, J. - Urbanová, Martina - Bartoníčková, E. - Palovčík, J. - Vetchý, D. - Czernek, Jiří - Janisova, Larisa - Velychkivska, Nadiia - Franc, A. - Brus, Jiří
    Structural changes of sodium warfarin in tablets affecting the dissolution profiles and potential safety of generic substitution.
    Pharmaceutics. Roč. 13, č. 9 (2021), s. 1-19, č. článku 1364. E-ISSN 1999-4923
    R&D Projects: GA MŠk(CZ) LTAUSA18011
    Research Infrastructure: e-INFRA CZ - 90140; ELIXIR-CZ - 90047
    Institutional support: RVO:61389013
    Keywords : warfarin * solid-state NMR * polymorphism
    Subject RIV: CF - Physical ; Theoretical Chemistry
    OBOR OECD: Physical chemistry
    Impact factor: 6.321, year: 2020
    Method of publishing: Open access
    https://www.mdpi.com/1999-4923/13/9/1364
    Permanent Link: http://hdl.handle.net/11104/0322298
     
     
  3. 3.
    0544076 - ÚMCH 2022 RIV CH eng J - Journal Article
    Czernek, Jiří - Brus, Jiří
    On the many-body expansion of an interaction energy of some supramolecular halogen-containing capsules.
    Molecules. Roč. 26, č. 15 (2021), s. 1-9, č. článku 4431. E-ISSN 1420-3049
    R&D Projects: GA MŠk(CZ) LTAUSA18011
    Grant - others:AV ČR(CZ) StrategieAV21/10
    Program:StrategieAV
    Research Infrastructure: e-INFRA CZ - 90140; ELIXIR-CZ - 90047
    Institutional support: RVO:61389013
    Keywords : non-covalent interactions * supramolecular capsules * interaction energy
    Subject RIV: CF - Physical ; Theoretical Chemistry
    OBOR OECD: Physical chemistry
    Impact factor: 4.411, year: 2020
    Method of publishing: Open access
    https://doi.org/10.3390/molecules26154431
    Permanent Link: http://hdl.handle.net/11104/0321906
     
     
  4. 4.
    0542067 - ÚMCH 2022 RIV GB eng J - Journal Article
    Švec, P. - Samsonov, M. A. - Růžičková, Z. - Brus, Jiří - Růžička, A.
    Oxidative addition of cyanogen bromide to C,N-chelated and Lappert's stannylenes.
    Dalton Transactions. Roč. 50, č. 16 (2021), s. 5519-5529. ISSN 1477-9226. E-ISSN 1477-9234
    R&D Projects: GA MŠk(CZ) LTAUSA18011
    Research Infrastructure: e-INFRA CZ - 90140
    Institutional support: RVO:61389013
    Keywords : physical-properties * metal alkyls * amides
    Subject RIV: CH - Nuclear ; Quantum Chemistry
    OBOR OECD: Inorganic and nuclear chemistry
    Impact factor: 4.390, year: 2020
    Method of publishing: Limited access
    https://pubs.rsc.org/en/content/articlelanding/2021/DT/D1DT00704A#!divAbstract
    Permanent Link: http://hdl.handle.net/11104/0319791
     
     
  5. 5.
    0541429 - ÚMCH 2022 RIV CH eng J - Journal Article
    Czernek, Jiří - Brus, Jiří
    A volumetric analysis of the 1H NMR chemical shielding in supramolecular systems.
    International Journal of Molecular Sciences. Roč. 22, č. 7 (2021), s. 1-12, č. článku 3333. E-ISSN 1422-0067
    R&D Projects: GA MŠk(CZ) LTAUSA18011
    Research Infrastructure: e-INFRA CZ - 90140; ELIXIR-CZ - 90047
    Institutional support: RVO:61389013
    Keywords : proton NMR * chemical shielding * antiaromaticity
    Subject RIV: CF - Physical ; Theoretical Chemistry
    OBOR OECD: Physical chemistry
    Impact factor: 5.923, year: 2020
    Method of publishing: Open access
    https://www.mdpi.com/1422-0067/22/7/3333
    Permanent Link: http://hdl.handle.net/11104/0319042
     
     
  6. 6.
    0533631 - ÚMCH 2021 RIV CH eng J - Journal Article
    Czernek, Jiří - Brus, Jiří
    Parametrizing the spatial dependence of 1H NMR chemical shifts in .pi.-stacked molecular fragments.
    International Journal of Molecular Sciences. Roč. 21, č. 21 (2020), s. 1-13, č. článku 7908. E-ISSN 1422-0067
    R&D Projects: GA MŠk(CZ) LTAUSA18011
    Research Infrastructure: e-INFRA CZ - 90140
    Institutional support: RVO:61389013
    Keywords : noncovalent interactions * proton NMR * intermolecular stacking
    Subject RIV: CF - Physical ; Theoretical Chemistry
    OBOR OECD: Physical chemistry
    Impact factor: 5.923, year: 2020
    Method of publishing: Open access
    https://www.mdpi.com/1422-0067/21/21/7908
    Permanent Link: http://hdl.handle.net/11104/0312402
     
     
  7. 7.
    0525568 - ÚMCH 2021 RIV CH eng J - Journal Article
    Czernek, Jiří - Brus, Jiří
    Polymorphic forms of valinomycin investigated by NMR crystallography.
    International Journal of Molecular Sciences. Roč. 21, č. 14 (2020), s. 1-13, č. článku 4907. E-ISSN 1422-0067
    R&D Projects: GA MŠk(CZ) LTAUSA18011
    Research Infrastructure: CESNET II - 90042; CERIT-SC - 90085
    Institutional support: RVO:61389013
    Keywords : valinomycin * antiviral * 2019-nCoV
    Subject RIV: CF - Physical ; Theoretical Chemistry
    OBOR OECD: Physical chemistry
    Impact factor: 5.923, year: 2020
    Method of publishing: Open access
    https://www.mdpi.com/1422-0067/21/14/4907
    Permanent Link: http://hdl.handle.net/11104/0309817
     
     
  8. 8.
    0510805 - ÚMCH 2020 RIV US eng J - Journal Article
    Urbanová, Martina - Pavelková, M. - Czernek, Jiří - Kubová, K. - Vysloužil, J. - Pechová, A. - Molinková, D. - Vysloužil, J. - Vetchý, D. - Brus, Jiří
    Interaction pathways and structure-chemical transformations of alginate gels in physiological environments.
    Biomacromolecules. Roč. 20, č. 11 (2019), s. 4158-4170. ISSN 1525-7797. E-ISSN 1526-4602
    R&D Projects: GA MŠk(CZ) LO1507; GA MŠk(CZ) LTAUSA18011
    Grant - others:AV ČR(CZ) StrategieAV21/10
    Program:StrategieAV
    Institutional support: RVO:61389013
    Keywords : alginate gels * molecular-level interactions * physiological conditions
    Subject RIV: CD - Macromolecular Chemistry
    OBOR OECD: Polymer science
    Impact factor: 6.092, year: 2019
    Method of publishing: Limited access
    https://pubs.acs.org/doi/10.1021/acs.biomac.9b01052
    Permanent Link: http://hdl.handle.net/11104/0302383
     
     
  9. 9.
    0507836 - ÚMCH 2020 RIV US eng J - Journal Article
    Hušák, M. - Jegorov, A. - Czernek, Jiří - Rohlíček, J. - Žižková, S. - Vraspír, P. - Kolesa, P. - Fitch, A. - Brus, Jiří
    Successful strategy for high degree of freedom crystal structure determination from powder X-ray diffraction data: a case study for selexipag form I with 38 DOF.
    Crystal Growth & Design. Roč. 19, č. 8 (2019), s. 4625-4631. ISSN 1528-7483. E-ISSN 1528-7505
    R&D Projects: GA MŠk(CZ) LTAUSA18011
    Institutional support: RVO:61389013
    Keywords : powder X-ray diffraction * DFT methods
    Subject RIV: CF - Physical ; Theoretical Chemistry
    OBOR OECD: Physical chemistry
    Impact factor: 4.089, year: 2019
    Method of publishing: Limited access
    https://pubs.acs.org/doi/10.1021/acs.cgd.9b00517
    Permanent Link: http://hdl.handle.net/11104/0298863