Autobiography of Doros N. Theodorou von Theodorou, Doros N.

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Interactions of a Novel Anthracycline with Oligonucleotide DNA and Cyclodextrins in an Aqueous Environment von Mikaelian, Georgios, Megariotis, Grigorios, Theodorou, Doros N.

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Progress and Outlook in Monte Carlo Simulations von Theodorou, Doros N.

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Molecular Modeling Investigations of Sorption and Diffusion of Small Molecules in Glassy Polymers von Vergadou, Niki, Theodorou, Doros N

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Structure of Polymer Layers Grafted to Nanoparticles in Silica–Polystyrene Nanocomposites von Vogiatzis, Georgios G, Theodorou, Doros N

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Equation of State Based Slip Spring Model for Entangled Polymer Dynamics von Vogiatzis, Georgios G, Megariotis, Grigorios, Theodorou, Doros N

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Topological Analysis of Linear Polymer Melts:  A Statistical Approach von Tzoumanekas, Christos, Theodorou, Doros N

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Equilibration of linear polyethylene melts with pre-defined molecular weight distributions employing united atom Monte Carlo simulations von Gerakinis, Dimitrios-Paraskevas, Anogiannakis, Stefanos D., Theodorou, Doros N.

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Molecular dynamics simulations of EPON-862/DETDA epoxy networks: structure, topology, elastic constants, and local dynamics von Kallivokas, Spyros V, Sgouros, Aristotelis P, Theodorou, Doros N

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Development of a Meshless Kernel-Based Scheme for Particle-Field Brownian Dynamics Simulations von Sgouros, Aristotelis P., Theodorou, Doros N.

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Molecular simulations of doxorubicin complexed with native and modified cyclodextrins in water von Mikaelian, Georgios, Megariotis, Grigorios, Theodorou, Doros N

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Multiscale simulations of polyzwitterions in aqueous bulk solutions and brush array configurations von Sgouros, Aristotelis P, Knippenberg, Stefan, Guillaume, Maxime, Theodorou, Doros N

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Local Segmental Dynamics and Stresses in Polystyrene–C60 Mixtures von Vogiatzis, Georgios G, Theodorou, Doros N

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Quasi-elastic neutron scattering and molecular dynamics simulation as complementary techniques for studying diffusion in zeolites von Jobic, Hervé, Theodorou, Doros N.

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Promising Route for the Development of a Computational Framework for Self-Assembly and Phase Behavior Prediction of Ionic Surfactants Using MARTINI von Anogiannakis, Stefanos D, Petris, Panagiotis C, Theodorou, Doros N

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Determination of the Mechanical Properties of a Poly(methyl methacrylate) Nanocomposite with Functionalized Graphene Sheets through Detailed Atomistic Simulations von Skountzos, Emmanuel N, Anastassiou, Alexandros, Mavrantzas, Vlasis G, Theodorou, Doros N

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Molecular Simulations and Mechanistic Analysis of the Effect of CO2 Sorption on Thermodynamics, Structure, and Local Dynamics of Molten Atactic Polystyrene von Ricci, Eleonora, Vergadou, Niki, Vogiatzis, Georgios G, De Angelis, Maria Grazia, Theodorou, Doros N

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Multiscale Molecular Simulations of Polymer-Matrix Nanocomposites von Vogiatzis, Georgios G, Theodorou, Doros N

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Multiscale Molecular Simulations of Polymer-Matrix Nanocomposites: or What Molecular Simulations Have Taught us About the Fascinating Nanoworld von Vogiatzis, Georgios G., Theodorou, Doros N.

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Molecular simulations of fluoxetine in hydrated lipid bilayers, as well as in aqueous solutions containing β-cyclodextrin von Megariotis, Grigorios, Mikaelian, Georgios, Avramopoulos, Aggelos, Romanos, Nikolaos, Theodorou, Doros N.

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