All Stories

  1. p‐cymene impairs SARS‐CoV‐2 and Influenza A (H1N1) viral replication: In silico predicted interaction with SARS‐CoV‐2 nucleocapsid protein and H1N1 nucleoprotein

    Article • Pharmacology Research & Perspectives, June 2021, Wiley

    Dr Vangelis Daskalakis

  2. The conformational phase space of the photoprotective switch in the major light harvesting complex II

    Article • Chemical Communications, January 2020, Royal Society of Chemistry

    Dr Vangelis Daskalakis

  3. Energizing the light harvesting antenna: Insight from CP29

    Article • Biochimica et Biophysica Acta (BBA) - Bioenergetics, October 2016, Elsevier

    Dr Vangelis Daskalakis

  4. Correlation between Surface Tension and the Bulk Dynamics in Salty Atmospheric Aquatic Droplets

    Article • The Journal of Physical Chemistry C, June 2016, American Chemical Society (ACS)

    Dr Vangelis Daskalakis

  5. Structure and properties of the catalytic site of nitric oxide reductase at ambient temperature

    Article • Biochimica et Biophysica Acta (BBA) - Bioenergetics, October 2015, Elsevier

    Dr Vangelis Daskalakis

  6. Surface-active organic matter induces salt morphology transitions during new atmospheric particle formation and growth

    Article • RSC Advances, January 2015, Royal Society of Chemistry

    Dr Vangelis Daskalakis

  7. Effects of surface-active organic matter on carbon dioxide nucleation in atmospheric wet aerosols: a molecular dynamics study

    Article • Physical Chemistry Chemical Physics, September 2014, Royal Society of Chemistry

    Dr Vangelis Daskalakis

  8. Hexagonal ice stability and growth in the presence of glyoxal and secondary organic aerosols

    Article • Physical Chemistry Chemical Physics, July 2014, Royal Society of Chemistry

    Dr Vangelis Daskalakis, Dr. Marios Hadjicharalambous

  9. Probing the Action of Cytochrome c Oxidase

    Article • January 2014, Springer Science + Business Media

    Dr Vangelis Daskalakis

  10. Non-linear vibrational modes in biomolecules: A periodic orbits description

    Article • Chemical Physics, May 2012, Elsevier

    Dr Vangelis Daskalakis

  11. The origin of the FeIV=O intermediates in cytochrome aa3 oxidase

    Article • Biochimica et Biophysica Acta (BBA) - Bioenergetics, April 2012, Elsevier

    Dr Vangelis Daskalakis, Dr Eftychia Pinakoulaki

  12. Tuning Heme Functionality: The Cases of Cytochrome c Oxidase and Myoglobin Oxidation

    Article • January 2012, Springer Science + Business Media

    Dr Vangelis Daskalakis

  13. Exploring the topography of free energy surfaces and kinetics of cytochrome c oxidases interacting with small ligands

    Article • RSC Advances, January 2012, Royal Society of Chemistry

    Dr Vangelis Daskalakis

  14. Regulation of Electron and Proton Transfer by the Protein Matrix of CytochromecOxidase

    Article • The Journal of Physical Chemistry B, April 2011, American Chemical Society (ACS)

    Dr Vangelis Daskalakis

  15. Vibrational Resonances and CuB Displacement Controlled by Proton Motion in Cytochrome c Oxidase

    Article • The Journal of Physical Chemistry B, December 2009, American Chemical Society (ACS)

    Dr Vangelis Daskalakis

  16. Binding and Docking Interactions of NO, CO and O2 in Heme Proteins as Probed by Density Functional Theory

    Article • International Journal of Molecular Sciences, September 2009, MDPI AG

    Dr Vangelis Daskalakis

  17. Heme Cavity Dynamics of Photodissociated CO from ba3-Cytochrome c Oxidase: The Role of Ring-D Propionate

    Article • The Journal of Physical Chemistry B, August 2009, American Chemical Society (ACS)

    Dr Vangelis Daskalakis

  18. Assigning Vibrational Spectra of Ferryl-Oxo Intermediates of Cytochrome c Oxidase by Periodic Orbits and Molecular Dynamics

    Article • Journal of the American Chemical Society, August 2008, American Chemical Society (ACS)

    Dr Vangelis Daskalakis

  19. Probing the Environment of CuB in Heme−Copper Oxidases

    Article • The Journal of Physical Chemistry B, August 2007, American Chemical Society (ACS)

    Dr Vangelis Daskalakis, Dr Eftychia Pinakoulaki

  20. Protein Dynamics and Spectroscopy for Ferryl Intermediate of Cytochrome c Oxidase: A Molecular Dynamics Approach

    Article • January 2007, American Institute of Physics

    Dr Vangelis Daskalakis

  21. Structural dynamics of heme-copper oxidases and nitric oxide reductases: time-resolved step-scan Fourier transform infrared and time-resolved resonance Raman studies

    Article • Journal of Raman Spectroscopy, January 2005, Wiley

    Dr Vangelis Daskalakis, Dr Eftychia Pinakoulaki

  22. Time-resolved step-scan Fourier transform infrared investigation of heme-copper oxidases: implications for O2 input and H2O/H+ output channels

    Article • Biochimica et Biophysica Acta (BBA) - Bioenergetics, April 2004, Elsevier

    Dr Vangelis Daskalakis, Dr Eftychia Pinakoulaki