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| Issue Date | Title | Author(s) |
| 7-Jun-2014 | Accurate prediction of the linear viscoelastic properties of highly entangled mono and bidisperse polymer melts | Stephanou, Pavlos S. ; Mavrantzas, Vlasis G. |
| 2008 | Assigning vibrational spectra of ferryl-oxo intermediates of cytochrome c oxidase by periodic orbits and molecular dynamics | Farantos, Stavros C. ; Varotsis, Constantinos ; Daskalakis, Vangelis |
| Sep-2009 | Binding and docking interactions of NO, CO and O 2 in heme proteins as probed by density functional theory | Varotsis, Constantinos ; Daskalakis, Vangelis |
| 3-May-2012 | Effects of Τube Persistence Length on Dynamics of Mildly Entangled Polymers | Qin, Jian ; Milner, Scott T. ; Stephanou, Pavlos S. ; Mavrantzas, Vlasis G. |
| 2007 | EGEE: Applications in Classical and Quantum Molecular Dynamics | Daskalakis, Vangelis ; Giatromanolakis, Manos ; Farantos, Stavros C. ; Gerbasi, Osvaldo |
| 22-Jun-2005 | Electronic and optical properties of a-c from tight-binding molecular dynamics simulations | Kopidakis, Georgios ; Kelires, Pantelis C. ; Mathioudakis, Christos |
| 3-Sep-2009 | Heme cavity dynamics of photodissociated CO from ba3-Cytochrome c oxidase : the role of ring-D propionate | Porrini, Massimiliano ; Daskalakis, Vangelis ; Farantos, Stavros C. ; Varotsis, Constantinos |
| 2-Dec-2004 | Influence of germanium ad-dimers on carbon incorporation in the si(001) surface | Sonnet, Ph ; Stauffer, Louise ; Kelires, Pantelis C. |
| 12-May-2006 | Insights into the fracture mechanisms and strength of amorphous and nanocomposite carbon | Fyta, Maria G. ; Remediakis, Ioannis N. ; Kelires, Pantelis C. |
| 10-Sep-1997 | Low-power picosecond resonance Raman evidence for histidine ligation to heme a3 after photodissociation of CO from cytochrome c oxidase | Schelvis, Johannes ; Deinum, Geurt ; Varotsis, Constantinos |
| Apr-2023 | A perspective on the major light-harvesting complex dynamics under the effect of pH, salts, and the photoprotective PsbS protein | Navakoudis, Eleni ; Stergiannakos, Taxiarchis ; Daskalakis, Vangelis |
| Sep-2017 | The Photosystem II Subunit S Dynamics under stress | Daskalakis, Vangelis ; Papadatos, Sotiris |
| 2-Sep-2004 | Physical trends in amorphous carbon: a tight-binding molecular-dynamics study | Kopidakis, Georgios ; Kelires, Pantelis C. ; Mathioudakis, Christos |
| 2007 | Protein dynamics and spectroscopy for ferryl intermediate of cytochrome c oxidase: a molecular dynamics approach | Farantos, Stavros C. ; Varotsis, Constantinos ; Daskalakis, Vangelis ; Farantos, Stavros C. |
| 7-May-2018 | Protein–protein interactions within photosystem II under photoprotection: the synergy between CP29 minor antenna, subunit S (PsbS) and zeaxanthin at all-atom resolution | Daskalakis, Vangelis |
| Oct-2013 | Quantitative predictions of the linear viscoelastic properties of entangled polyethylene and polybutadiene melts via modified versions of modern tube models on the basis of atomistic simulation data | Stephanou, Pavlos S. ; Mavrantzas, Vlasis G. |
| 2007 | Simulations of nanocomposite carbon films | Kelires, Pantelis C. |
| 1-Jan-2015 | Surface-active organic matter induces salt morphology transitions during new atmospheric particle formation and growth | Daskalakis, Vangelis ; Charalambous, Fevronia ; Demetriou, Constantinos ; Georgiou, Georgia |
| Sep-1993 | Theory of electronic properties of amorphous silicon-carbon alloys: effects of short-range disorder | Denteneer, P. J H ; Kelires, Pantelis C. |
| 22-Dec-2003 | Time-resolved resonance raman and time-resolved step-scan FTIR studies of nitric oxide reductase from paracoccus denitrificans: comparison of the heme b3-FeB site to that of the heme-CuB in oxidases | Pinakoulaki, Eftychia ; Varotsis, Constantinos |
