Search results for "model system"
showing 10 items of 55 documents
Performance of Different Force Fields in Force Probe Simulations
2013
We present detailed force probe molecular dynamic simulations of mechanically interlocked dimeric calix[4]arene-catenanes, comparing the results obtained using three different commonly used force fields (GROMOS G53a5, OPLS-AA, and AMBER GAFF). The model system is well characterized as a two-state system consisting of a closed compact and an elongated structure. Both states are stabilized by a different hydrogen-bond network, and complete separation of the dimer is prevented by the mechanical lock of the entangled aliphatic loops. The system shows fully reversible rebinding meaning that after bond rupture the system rejoins when the external force is relaxed. We present a detailed study of q…
Experimental visualization of inoculation using a charged colloidal model system
2012
Inoculation is widely used to tune the microstructure of a polycrystalline solid from the melt and thus its material properties. We present here a systematic time resolved experimental study of inoculation in a charged colloidal model system investigating the changes of the crystallization scenario upon adding spherical seeds and show that the nucleation kinetics solely determines the resulting microstructure.
Full inhibition of enzymatic browning in the presence of thiol-functionalised silica nanomaterial
2018
[EN] Darkening processed fruits and vegetables is caused mainly by enzymatic browning through polyphenol oxidase (PPO) action. Accordingly, we explored the potential of four silica-based materials (MCM-41 nanometric size, MCM-41 micrometric size, UVM-7 and aerosil), non-functionalised and functionalised with thiol groups, to inhibit PPO activity in the model system and apple juice. All materials showed relevant performance when immobilising and inhibiting PPO in model systems, and support topology is a main factor for enzyme immobilisation and inhibition. Thiol-containing silica UVM7-SH showed the greatest inactivation, and similar browning values to those obtained by acidification. The enz…
Real-time switching between multiple steady-states in quantum transport
2010
Creative Commons Attribution License 3.0.
Disentangling boson peaks and Van Hove singularities in a model glass
2018
Using the example of a two-dimensional macroscopic model glass in which the interparticle forces can be precisely measured, we obtain strong hints for resolving a controversy concerning the origin of the anomalous enhancement of the vibrational spectrum in glasses (boson peak). Whereas many authors attribute this anomaly to the structural disorder, some other authors claim that the short-range order, leading to washed-out Van Hove singularities, would cause the boson-peak anomaly. As in our model system, the disorder-induced and shortrange--order-induced features can be completely separated, we are able to discuss the controversy about the boson peak in real glasses in a new light. Our find…
Exploring the Physical Limits of Saturation Contrast in Magnetic Resonance Imaging
2012
International audience; Magnetic Resonance Imaging has become nowadays an indispensable tool with applications ranging from medicine to material science. However, so far the physical limits of the maximum achievable experimental contrast were unknown. We introduce an approach based on principles of optimal control theory to explore these physical limits, providing a benchmark for numerically optimized robust pulse sequences which can take into account experimental imperfections. This approach is demonstrated experimentally using a model system of two spatially separated liquids corresponding to blood in its oxygenated and deoxygenated forms.
Monte Carlo simulations of the 2d-Ising model in the geometry of a long stripe
2011
Abstract The two-dimensional Ising model in the geometry of a long stripe can be regarded as a model system for the study of nanopores. As a quasi-one-dimensional system, it also exhibits a rather interesting “phase behavior”: At low temperatures the stripe is either filled with “liquid” or “gas” and “densities” are similar to those in the bulk. When we approach a “pseudo-critical point” (below the critical point of the bulk) at which the correlation length becomes comparable to the length of the stripe, several interfaces emerge and the systems contains multiple “liquid” and “gas” domains. The transition depends on the size of the stripe and occurs at lower temperatures for larger stripes.…
Imaging Trapped Ion Structures via Fluorescence Cross-Correlation Detection
2021
Cross-correlation signals are recorded from fluorescence photons scattered in free space off a trapped ion structure. The analysis of the signal allows for unambiguously revealing the spatial frequency, thus the distance, as well as the spatial alignment of the ions. For the case of two ions we obtain from the cross-correlations a spatial frequency ${f}_{\text{spatial}}=1490\ifmmode\pm\else\textpm\fi{}{2}_{\mathrm{stat}}\ifmmode\pm\else\textpm\fi{}{8}_{\mathrm{syst}}\text{ }\text{ }{\mathrm{rad}}^{\ensuremath{-}1}$, where the statistical uncertainty improves with the integrated number of correlation events as ${N}^{\ensuremath{-}0.51\ifmmode\pm\else\textpm\fi{}0.06}$. We independently deter…
The Role of Autophagy and Apoptosis During Embryo Development
2015
Programmed cell death (PCD) and cell survival are two sides of the same coin. Autopha‐ gy and apoptosis are crucial processes during embryo development of Invertebrates and Vertebrates organisms, as they are necessary for the formation of a new organism, start‐ ing from a fertilized egg. Fertilization triggers cell remodeling from each gamete to a toti‐ potent zygote. During embryogenesis, the cells undergo various processes, thus allowing the transformation of the embryo into an adult organism. In particular, cells require the appropriate tools to suddenly modify their morphology and protein content in order to respond to intrinsic and external stimuli. Autophagy and apoptosis are involved…
Magnetic breakdown and charge density wave formation: a quantum oscillation study of the rare-earth tritellurides
2020
The rare-earth tritellurides ($R$Te$_3$, where $R$ = La, Ce, Pr, Nd, Sm, Gd, Tb, Dy, Ho, Er, Tm, Y) form a charge density wave state consisting of a single unidirectional charge density wave for lighter $R$, with a second unidirectional charge density wave, perpendicular and in addition to the first, also present at low temperatures for heavier $R$. We present a quantum oscillation study in magnetic fields up to 65T that compares the single charge density wave state with the double charge density wave state both above and below the magnetic breakdown field of the second charge density wave. In the double charge density wave state it is observed that there remain several small, light pockets…