Size and Diffusivity of Polymer Rings in Linear Polymer Matrices: The Key Role of Threading Events von Tsalikis, Dimitrios G, Mavrantzas, Vlasis G

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All-Atom Molecular Dynamics Simulation of Temperature Effects on the Structural, Thermodynamic, and Packing Properties of the Pure Amorphous and Pure Crystalline Phases of Regioreg... von Alexiadis, Orestis, Mavrantzas, Vlasis G

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Excluded-Volume Interactions in Field-Theoretic Simulations: Multiconvolutions and Model Equivalence von Weyman, Alexander, Mavrantzas, Vlasis G.

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Effect of pH and Molecular Length on the Structure and Dynamics of Short Poly(acrylic acid) in Dilute Solution: Detailed Molecular Dynamics Study von Mintis, Dimitris G, Mavrantzas, Vlasis G

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Using Monte Carlo to Simulate Complex Polymer Systems: Recent Progress and Outlook von Mavrantzas, Vlasis G.

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Analysis of Slow Modes in Ring Polymers: Threading of Rings Controls Long-Time Relaxation von Tsalikis, Dimitrios G, Mavrantzas, Vlasis G, Vlassopoulos, Dimitris

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Flow Effects on Melt Structure and Entanglement Network of Linear Polymers: Results from a Nonequilibrium Molecular Dynamics Simulation Study of a Polyethylene Melt in Steady Shear von Baig, Chunggi, Mavrantzas, Vlasis G, Kröger, Martin

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Simple, Accurate and User-Friendly Differential Constitutive Model for the Rheology of Entangled Polymer Melts and Solutions from Nonequilibrium Thermodynamics von Stephanou, Pavlos S., Tsimouri, Ioanna Ch, Mavrantzas, Vlasis G.

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Field-theoretic simulations beyond δ-interactions: Overcoming the inverse potential problem in auxiliary field models von Weyman, Alexander, Mavrantzas, Vlasis G., Öttinger, Hans Christian

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Effect of Polymer Concentration on the Structure and Dynamics of Short Poly(N,N‑dimethylaminoethyl methacrylate) in Aqueous Solution: A Combined Experimental and Molecular Dynamics... von Mintis, Dimitris G, Dompé, Marco, Kamperman, Marleen, Mavrantzas, Vlasis G

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Respiratory and lower limb muscle function in interstitial lung disease von Panagiotou, Marios, Polychronopoulos, Vlasis, Strange, Charlie

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Direct calculation of the functional inverse of realistic interatomic potentials in field-theoretic simulations von Weyman, Alexander, Mavrantzas, Vlasis G., Öttinger, Hans Christian

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Dynamic Heterogeneity in Ring-Linear Polymer Blends von Katsarou, Anna F., Tsamopoulos, Alexandros J., Tsalikis, Dimitrios G., Mavrantzas, Vlasis G.

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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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Threading of Ring Poly(ethylene oxide) Molecules by Linear Chains in the Melt von Tsalikis, Dimitrios G, Mavrantzas, Vlasis G

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Conformational and Dynamic Properties of Short DNA Minicircles in Aqueous Solution from Atomistic Molecular Dynamics Simulations von Alexiou, Terpsichori S, Alatas, Panagiotis V, Tsalikis, Dimitrios G, Mavrantzas, Vlasis G

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The effect of functional groups on the glass transition temperature of atmospheric organic compounds: a molecular dynamics study von Siachouli, Panagiota, Karadima, Katerina S, Mavrantzas, Vlasis G, Pandis, Spyros N

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Molecular Dynamics Simulation of Amorphous Poly(3-hexylthiophene) von Tsourtou, Flora D, Peristeras, Loukas D, Apostolov, Rossen, Mavrantzas, Vlasis G

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Parallel, grid-adaptive approaches for relativistic hydro and magnetohydrodynamics von Keppens, R., Meliani, Z., van Marle, A.J., Delmont, P., Vlasis, A., van der Holst, B.

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Phase Boundary and Salt Partitioning in Coacervate Complexes Formed between Poly(acrylic acid) and Poly(N,N‑dimethylaminoethyl methacrylate) from Detailed Atomistic Simulations Com... von Mintis, Dimitris G, Mavrantzas, Vlasis G

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