Results 1-20 of 54 (Search time: 0.0 seconds).

Issue DateTitleAuthor(s)
12008Assigning vibrational spectra of ferryl-oxo intermediates of cytochrome c oxidase by periodic orbits and molecular dynamicsFarantos, Stavros C. ; Varotsis, Constantinos ; Daskalakis, Vangelis 
26-Feb-2017Atmospheric ice nucleation by glassy organic compounds: a reviewSalameh, Anastasia ; Daskalakis, Vangelis 
3Sep-2009Binding and docking interactions of NO, CO and O 2 in heme proteins as probed by density functional theoryVarotsis, Constantinos ; Daskalakis, Vangelis 
413-Aug-2020The conformational phase space of the photoprotective switch in the major Light Harvesting Complex IIDaskalakis, Vangelis ; Papadatos, Sotiris ; Stergiannakos, Taxiarchis 
52-Jun-2016Correlation between Surface Tension and the Bulk Dynamics in Salty Atmospheric Aquatic DropletsSalameh, Anastasia ; Vorka, Flora ; Daskalakis, Vangelis 
6Dec-2016Correlation Between Surface Tension and the Bulk Dynamics in Salty Atmospheric Aquatic DropletsDaskalakis, Vangelis ; Salameh, Anastasia 
71-Feb-2017Coupling of helix E-F motion with the O-nitrito and 2-nitrovinyl coordination in myoglobinIoannou, Androulla ; Lambrou, Alexandra ; Daskalakis, Vangelis ; Pinakoulaki, Eftychia 
8Jul-2009Cytochrome c Oxidase + O2 reaction intermediates as probed by Density Functional Theory: The Proximal and Distal to heme a3 effectsDaskalakis, Vangelis ; Varotsis, Constantinos 
95-Aug-2017Detection of Maillard reaction products by a coupled HPLC-Fraction collector technique and FTIR characterization of Cu(II)-complexation with the isolated speciesIoannou, Aristos ; Daskalakis, Vangelis ; Varotsis, Constantinos 
105-Apr-2017Detection of Maillard reaction products by a coupled HPLC-Fraction collector technique and FTIR characterization of Cu(II)-complexation with the isolated speciesIoannou, Aristos ; Daskalakis, Vangelis ; Varotsis, Constantinos 
112002DFT Study of endoperoxides and their in-termediates in Fe(II) cleavage of the endoperoxy bridgeDaskalakis, Vangelis ; Frudakis, George ; Varotsis, Constantinos 
122006Diogygen activation and bond cleavage in cell respiration as probed by resonance raman spectroscopyPinakoulaki, Eftychia ; Ohta, Takehiro ; Daskalakis, Evangelos ; Aggelaki, M. ; Kitagawa, Teizo ; Ludwig, Bernd ; Varotsis, Constantinos 
13Nov-2017The effect of proton and potential gradients on integral membrane proteins: Insights from Molecular Dynamics simulationsDaskalakis, Vangelis 
1421-Nov-2014Effects of surface-active organic matter on carbon dioxide nucleation in atmospheric wet aerosols: A molecular dynamics studyDaskalakis, Vangelis ; Charalambous, Fevronia ; Panagiotou, Fostira ; Nearchou, Irene 
152007EGEE: Applications in Classical and Quantum Molecular DynamicsDaskalakis, Vangelis ; Giatromanolakis, Manos ; Farantos, Stavros C. ; Gerbasi, Osvaldo 
161-Oct-2016Energizing the light harvesting antenna: Insight from CP29Ioannidis, Nikolaos E. ; Papadatos, Sotiris ; Daskalakis, Vangelis 
1713-Apr-2012Exploring the topography of free energy surfaces and kinetics of cytochrome c oxidases interacting with small ligandsPorrini, Massimiliano ; Farantos, Stavros C. ; Daskalakis, Vangelis ; Porrini, Massimiliano 
181-Dec-2019Fine tuning of the photosystem II major antenna mobility within the thylakoid membrane of higher plantsDaskalakis, Vangelis ; Papadatos, Sotiris ; Kleinekathöfer, Ulrich 
19Jul-2015Globin Nitrito Heme Fe-O-N=O/ 2-Nitrovinyl Species: Impications for Myoglobin Helices DynamicsDaskalakis, Vangelis ; Pinakoulaki, Eftychia 
202012Grid computing multiple shooting algorithms for extended phase space sampling and long time propagation in molecular dynamicsDaskalakis, Vangelis ; Giatromanolakis, Manos ; Porrini, Massimiliano ; Farantos, Stavros C. ; Gervasi, Osvaldo