Projects funded by the NCN

Information on the principal investigator and host institution

Information of the project and the call

Keywords

Equipment

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Picture of molecular interactions in systems of molecules with anesthetic properties - from an isolated monomer to complexes with biomolecules

2012/05/B/ST4/02029

Keywords:

Inhalation anesthetics Cryospectroscopy FTIR-ATR Spectroscopy Vibrational Circular Dichroism (VCD) Oxygen bases Lipids Proteins Unconventional hydrogen bonds Quantum chemical calculations

Descriptors:

  • ST4_3: Molecular architecture and structure
  • ST4_13: Solid-state chemistry, surface physicochemistry
  • ST4_15: Colloid chemistry

Panel:

ST4 - Chemistry: physical chemistry/chemical physics, theoretical chemistry, analytical chemistry, inorganic chemistry, organic chemistry, method development

Host institution :

Uniwersytet Wrocławski, Wydział Chemii

woj. dolnośląskie

Other projects carried out by the institution 

Principal investigator (from the host institution):

prof. Maria Rospenk 

Number of co-investigators in the project: 7

Call: OPUS 3 - announced on 2012-03-15

Amount awarded: 798 461 PLN

Project start date (Y-m-d): 2013-02-14

Project end date (Y-m-d): 2016-12-13

Project duration:: 46 months (the same as in the proposal)

Project status: Project settled

Equipment purchased [PL]

  1. Komputer PC i kolorowa drukarka. (5 000 PLN)
  2. Zewnętrzny optyczny moduł pomiarowy PEM do pomiarów VCD mocowany na stałe z boku spektrometru NEXUS (zapewniający wykonywanie widm IR bez demontażu modułu VCD). Wyposażenie do VCD obejmuje: zestaw modulatora fotoelastycznego PEM 50 kHz (składającego się z kontrolera, głowicy, polaryzatora typu wire grid" o prześwicie 30mm); uchwyt do próbek VCD (przystosowany do kuwet do pomiaru widm próbek ciekłych); demodulator typu SSD ("synchronous sampling demodulator") 50 kHz z elektronicznym filtrem pasmowym fabrycznie zestrojony z modulatorem PEM). Plus dodatkowe wyposażenie i oprogramowanie niezbędne do współpracy tego modułu ze spektrometrem NEXUS (485 850 PLN)

Information in the final report

  • Publication in academic press/journals (17)
  • Book publications / chapters in book publications (1)
  1. Influence of inhalation anesthetics on the chain-melting phase transition of DPPC liposomes. Near-infrared spectroscopy studies supported by PCA analysis
    Authors:
    Marta Kuć, Katarzyna Cieślik-Boczula, Maria Rospenk
    Academic press:
    Vibrational Spectroscopy (rok: 2016, tom: 85, strony: 55-61), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.vibspec.2016.03.026 - link to the publication
  2. MCR-ALS as an effective tool for monitoring subsequent phase transitions in pure and doped DPPC liposomes
    Authors:
    Katarzyna Cieślik-Boczula, Bogusława Czarnik-Matusewicz, Margarita Perevozkina and Maria Rospenk
    Academic press:
    RSC Advances (rok: 2015, tom: 5, strony: 40455-40464), Wydawca: Royal Society of Chemistry
    Status:
    Published
    DOI:
    10.1039/c5ra04234h - link to the publication
  3. Fluphenazine : from an isolated molecule to its interaction with lipid bilayers.
    Authors:
    Petrus J., Czarnik-Matusewicz B., Petrus R., Cieślik-Boczula K., Jaszczyszyn A., Gąsiorowski K.
    Academic press:
    Chemistry and Physics of Lipids (rok: 2015, tom: 186, strony: 51-60), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.chemphyslip.2015.01.002 - link to the publication
  4. IR Spectra of Halothane–Acetone Complex in Liquefied Noble Gases (Kr and Xe)
    Authors:
    S. M. Melikova, K. S. Rutkowski, M. Rospenk
    Academic press:
    Optics and Spectroscopy (rok: 2017, tom: 123, strony: 30-37), Wydawca: © Pleiades Publishing, Ltd., 2017.
    Status:
    Published
    DOI:
    10.1134/S0030400X17070177 - link to the publication
  5. Infrared spectroscopy and ab initio study of hydrogen bonded Cl3CD N(CH3)3 complex in the gas phase
    Authors:
    K.S. Rutkowski, S.M. Melikova, O.V. Linok B. Czarnik-Matusewicz, M.Rospenk
    Academic press:
    Spectrochimicz Acta Part A: Molecular and Biomolecular Spectroscopy (rok: 2015, tom: 136, strony: 95-99), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.055 - link to the publication
  6. Ph-induced structural changes of ovalbumin studied by 2D correlation IR spectroscopy
    Authors:
    Daehoon Kang, Soo Ryeon Ryu, Yeonju Park, Bogusława Czarnik-Matusewicz, Young Mee Jung
    Academic press:
    Journal of Molecular Structure (rok: 2014, tom: 1069, strony: 299-304), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.molstruc.2014.02.061 - link to the publication
  7. Phase Separation in Phosphatidylcholine Membrane Caused by the Presence of a Pyrimidine Analogue of Fluphenazine with High Anti-Multidrug-Resistance Activity
    Authors:
    Katarzyna Cieślik-Boczula, Piotr Świątek, Agata Jaszczyszyn, Patrycja Zawilska, Kazimierz Gąsiorowski, Wiesław Malinka, Gottfried Köhler
    Academic press:
    Journal of Physical Chemistry B (rok: 2014, tom: 118, strony: 3605-3615), Wydawca: ACS Publication
    Status:
    Published
    DOI:
    10.1021/jp410882r - link to the publication
  8. Studying the influence of enflurane, isoflurane, and sevoflurane on the DPPC lipid bilayer using the analysis of variance and parallel factor analysis
    Authors:
    Martyna Horochowska, Ivana Stanimirova, Boguslawa Czarnik-Matusewicz
    Academic press:
    Chemometrics and Intelligent Laboratory Systems (rok: 2016, tom: 153, strony: 146-152), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.chemolab.2016.03.003 - link to the publication
  9. Vibrational spectra and conformational analysis of desflurane. A cryosolution and ab initio study
    Authors:
    S.M. Melikova, K.S. Rutkowski, B. Czarnik-Matusewicz, M. Rospenk
    Academic press:
    Chemical Physics Letters (rok: 2015, tom: 637, strony: 77-82), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.cplett.2015.07.063 - link to the publication
  10. FTIR and Raman spectra of CH(D)FC-ACF2-O-CHF derivatives of enflurane. Experimental and ab initio study
    Authors:
    S.M. Melikova, K.S. Rutkowsk, E. Telkovaa, B. Czarnik-Matusewicz, M. Rospenk, W. Herrebout
    Academic press:
    Chemical Physics (rok: 2015, tom: 453-454, strony: 26-34), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.chemphys.2015.03.010 - link to the publication
  11. The transition from the native to the acid-state characterized by multi-spectroscopy approach: Study for the holo-form of bovine α-lactalbumin.
    Authors:
    Adriana Litwińczuk, Soo Ryeon Ryu, Laurence A Nafie, Jong Wha Lee, Hugh I Kim, Young Mee Jung, Bogusława Czarnik-Matusewicz
    Academic press:
    Biochimica et Biophysica Acta (rok: 2014, tom: 18/44, strony: 593-606), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.bbapap.2013.12.018 - link to the publication
  12. Towards understanding the spectroscopic features of enflurane. The fundamental and overtone bands of CH stretchig vibrations
    Authors:
    S.M. Melikova, K.S. Rutkowski, B.Czarnik-Matusewicz, M. Rospenk
    Academic press:
    Chemical Physics Letters (rok: 2014, tom: 604, strony: 68 - 71), Wydawca: Elswvier
    Status:
    Published
    DOI:
    10.1016/j.cplett.2014.04.057 - link to the publication
  13. Anesthetic-dependent changes in the chain-melting phase transition of DPPG liposomes studied using near-infrared spectroscopy supported by PCA
    Authors:
    Marta Kuć, Katarzyna Cieślik-Boczula, Maria Rospenk
    Academic press:
    Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy (rok: 2017, tom: 186, strony: 37–43), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.saa.2017.06.003 - link to the publication
  14. Conformational origin of temperature changes in the IR spectrum of isoflurane. A cryosolution and ab initio study
    Authors:
    S.M. Melikova, K.S. Rutkowski, M. Horochowska, M. Rospenk
    Academic press:
    Journal of Molecular Structure (rok: 2017, tom: 1134, strony: 374-380), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.molstruc.2016.12.086 - link to the publication
  15. FTIR cryospectroscopic and ab initio studies of desflurane–dimethyl ether H–bonded complexes
    Authors:
    S.M. Melikova , K.S. Rutkowski, M. Rospenk
    Academic press:
    Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy (rok: 2017, tom: 184, strony: 163–168), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.saa.2017.04.084 - link to the publication
  16. FTIR-ATR study of the influence of the pyrimidine analog of fluphenazine on the chain-melting phase transition of sphingomyelin membranes
    Authors:
    Marta Kuć, Katarzyna Cieślik-Boczula, Piotr Swiątek, Agata Jaszczyszyn, Kazimierz Gąsiorowski, Wiesław Malinka
    Academic press:
    Chemical Physics (rok: 2015, tom: 458, strony: 45552), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.chemphys.2015.06.010 - link to the publication
  17. The gas phase FTIR studies of chloroform + B and halothane + B (B=TMA, FCD3) mixtures
    Authors:
    K.S. Rutkowski, S.M. Melikova, R.E. Asfin, B. Czarnik-Matusewicz, M. Rospenk
    Academic press:
    Journal of Molecular Structure (rok: 2014, tom: 1072, strony: 32-37), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.molstruc.2013.12.014 - link to the publication
  1. Two-Dimensional Mid-Infrared Correlation Spectroscopy in Protein Research
    Authors:
    Bogusława Czarnik-Matusewicz and Young Mee Jung
    Book:
    Optical Spectroscopy and Computational Methods in Biology and Medicine (rok: 2014, tom: 14, strony: 213-252), Wydawca: Springer
    Status:
    Published
    DOI:
    link to the publication

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