Vagelis A Harmandaris
Overview
Explore the profile of Vagelis A Harmandaris including associated specialties, affiliations and a list of published articles.
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Articles
11
Citations
292
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Recent Articles
1.
Christofi E, Bacova P, Harmandaris V
J Chem Inf Model
. 2024 Aug;
64(17):6926.
PMID: 39158929
No abstract available.
2.
Christofi E, Bacova P, Harmandaris V
J Chem Inf Model
. 2024 Mar;
64(6):1853-1867.
PMID: 38427962
Multiscale modeling of complex molecular systems, such as macromolecules, encompasses methods that combine information from fine and coarse representations of molecules to capture material properties over a wide range of...
3.
Mohammadi M, Patsalidis N, Bhowmick S, Harmandaris V, Biskos G
RSC Adv
. 2023 Jun;
13(26):18014-18024.
PMID: 37323454
We provide a comprehensive investigation of intermolecular interactions between atmospheric gaseous pollutants, including CH, CO, CO, NO, NO, SO, as well as HO and Ag ( = 1-22) or Au...
4.
Christofi E, Chazirakis A, Chrysostomou C, Nicolaou M, Li W, Doxastakis M, et al.
J Chem Phys
. 2022 Nov;
157(18):184903.
PMID: 36379782
Despite the modern advances in the available computational resources, the length and time scales of the physical systems that can be studied in full atomic detail, via molecular simulations, are...
5.
Zhang G, Chazirakis A, Harmandaris V, Stuehn T, Daoulas K, Kremer K
Soft Matter
. 2018 Dec;
15(2):289-302.
PMID: 30543257
We demonstrate that hierarchical backmapping strategies incorporating generic blob-based models can equilibrate melts of high-molecular-weight polymers, described with chemically specific, atomistic models. The central idea is first to represent polymers...
6.
Behbahani A, Allaei S, H Motlagh G, Eslami H, Harmandaris V
Soft Matter
. 2018 Feb;
14(8):1449-1464.
PMID: 29393331
Poly(methyl-methacrylate), PMMA, is a disubstituted vinyl polymer whose properties depend significantly on its tacticity. Here we present a detailed study of the structure, conformation, and dynamics of syndiotactic, atactic, and...
7.
Harmandaris V, Kremer K, Floudas G
Phys Rev Lett
. 2013 May;
110(16):165701.
PMID: 23679622
Binary blends of polystyrene with oligostyrene are perfectly miscible (χ=0) yet dynamically heterogeneous. This is evidenced by independent probing of the dipole relaxation perpendicular to the backbone by dielectric spectroscopy...
8.
Fritz D, Koschke K, Harmandaris V, van der Vegt N, Kremer K
Phys Chem Chem Phys
. 2011 Apr;
13(22):10412-20.
PMID: 21468407
Many physical phenomena and properties of soft matter systems are characterized by an interplay of interactions and processes that span a wide range of length- and time scales. Computer simulation...
9.
Reynwar B, Illya G, Harmandaris V, Muller M, Kremer K, Deserno M
Nature
. 2007 May;
447(7143):461-4.
PMID: 17522680
Membrane remodelling plays an important role in cellular tasks such as endocytosis, vesiculation and protein sorting, and in the biogenesis of organelles such as the endoplasmic reticulum or the Golgi...
10.
Harmandaris V, Deserno M
J Chem Phys
. 2006 Dec;
125(20):204905.
PMID: 17144738
The tensile force along a cylindrical lipid bilayer tube is proportional to the membrane's bending modulus and inversely proportional to the tube radius. We show that this relation, which is...