The effect of ZIF-90 particle in Pebax/Psf composite membrane on the transport properties of CO2, CH4 and N2 gases by Molecular Dynamics Simulation method

Nowadays, mixed matrix membranes (MMMs) have considered by many researchers to overcome the problems of polymeric membranes. In addition, molecular dynamics (MD) and Monte Carlo (MC) simulation Methods are suitable tools for studying transport properties and morphology in MMMs. For this purpose, in this study using material studio 2017 (MS) software, the transport properties of CO₂, CH₄ and N₂ in Pebax, Psf neat Pebax/Psf composite and Pebax/Psf composite filled with ZIF-90 particles have been investigated. By adding Psf to Pebax matrix, the selectivity of CO₂/CH₄ and CO₂/N₂ gases has significantly increased. In addition, adding ZIF-90 particles to the Pebax/Psf composite increased the permeability of CO₂, CH₄ and N₂ compared to neat and composite membranes. The morphological properties of the membranes, such as the fractional free volume (FFV), radial distribution function (RDF), glass transition temperature (T_G), X-ray diffraction (XRD) and equilibrium density have calculated and acceptable results have obtained.     

Investigating the possibility of Sonofusion in Deuterated acetone

In this article, energetic implosion of a single vapor bubble induced by a standing acoustic wave is theoretically studied and the Sonoluminescing bubble parameters involved in Sonofusion in Deuterated acetone (C₃D₆O) are investigated. Parameters such as radius, wall velocity, interior temperature and pressure of the bubble influenced by various driving pressure amplitudes in Deuterated acetone at ∼0 °C are investigated. Based on the obtained results, the possibility of thermonuclear fusion inside imploding cavitation bubbles is discussed. The interior pressure of C₃D₆O vapor bubbles at the collapse time is extremely high and the increase of the pressure amplitude increases the pressure inside the bubble. Our findings reveal that the maximum temperature inside acoustic-induced cavitation bubble in Deuterated acetone increases with the acoustic pressure amplitude and it is much higher than the maximum temperature inside acoustic induced cavitation bubbles in liquids such as water and acids. Consequently, the calculated temperature at the pressure amplitude of 7.23 bar was about 3.7 × 10⁵ K and it is predicted that at the reported experimental condition, the case of a bubble cluster subjected to the pressure amplitude of about 15 bar, the temperature inside the bubble reaches to 1.2 × 10⁶ K.     

Morphology and rheological properties of compatibilized low‐density polyethylene/linear low‐density polyethylene/thermoplastic starch blends

Morphology and rheological properties of low‐density polyethylene/linear low‐density polyethylene/thermoplastic starch (LDPE/LLDPE/TPS) blends are experimentally investigated and theoretically analyzed using rheological models. Blending of LDPE/LLDPE (70/30 wt/wt) with 5–20 wt % of TPS and 3 wt % of PE‐grafted maleic anhydride (PE‐g‐MA) as a compatibilizer is performed in a twin‐screw extruder. Scanning electron micrographs show a fairly good dispersion of TPS in PE matrices in the presence of PE‐g‐MA. However, as the TPS content increases, the starch particle size increases. X‐ray diffraction patterns exhibit that with increase in TPS content, the intensity of the crystallization peaks slightly decreases and consequently crystal sizes of the blends decrease. The rheological analyses indicate that TPS can increase the elasticity and viscosity of the blends. With increasing the amount of TPS, starch particles interactions intensify and as a result the blend interface become weaker which are confirmed by relaxation time spectra and the prediction results of emulsion Palierne and Gramespacher‐Meissner models. It is demonstrated that there is a better agreement between experimental rheological data and Coran model than the emulsion models. © 2017 Wiley Periodicals, Inc. J. Appl. Polym. Sci. 2017 , 134, 44719.     

CDC42-IQGAP Interactions Scrutinized: New Insights into the Binding Properties of the GAP-Related Domain

The IQ motif-containing GTPase-activating protein (IQGAP) family composes of three highly-related and evolutionarily conserved paralogs (IQGAP1, IQGAP2 and IQGAP3), which fine tune as scaffolding proteins numerous fundamental cellular processes. IQGAP1 is described as an effector of CDC42, although its effector function yet re-mains unclear. Biophysical, biochemical and molecular dynamic simulation studies have proposed that IQGAP RASGAP-related domains (GRDs) bind to the switch regions and the insert helix of CDC42 in a GTP-dependent manner. Our kinetic and equilibrium studies have shown that IQGAP1 GRD binds, in contrast to its C-terminal 794 amino acids (called C794), CDC42 in a nucleotide-independent manner indicating a binding outside the switch regions. To resolve this discrepancy and move beyond the one-sided view of GRD, we carried out affinity measurements and a systematic mutational analysis of the interfacing residues between GRD and CDC42 based on the crystal structure of the IQGAP2 GRD-CDC42^Q61L GTP complex. We determined a 100-fold lower affinity of the GRD1 of IQGAP1 and of GRD2 of IQGAP2 for CDC42 mGppNHp in comparison to C794/C795 proteins. Moreover, partial and major mutation of CDC42 switch regions substantially affected C794/C795 binding but only a little GRD1 and remarkably not at all the GRD2 binding. However, we clearly showed that GRD2 contributes to the overall affinity of C795 by using a 11 amino acid mutated GRD variant. Furthermore, the GRD1 binding to the CDC42 was abolished using specific point mutations within the insert helix of CDC42 clearly supporting the notion that CDC42 binding site(s) of IQGAP GRD lies outside the switch regions among others in the insert helix. Collectively, this study provides further evidence for a mechanistic framework model that is based on a multi-step binding process, in which IQGAP GRD might act as a ‘scaffolding domain’ by binding CDC42 irrespective of its nucleotide-bound forms, followed by other IQGAP domains downstream of GRD that act as an effector domain and is in charge for a GTP-dependent interaction with CDC42.     

Optimization of the Degumming Process for Aqueous-Extracted Wild Almond Oil

Wild almond (Amygdalus scoparia) oil is rich in oleic acid and, considering both nutritional and stability points of view, it can be utilized for future food applications. In the current study, acid degumming was investigated based on a method by response surface methodology using four degumming parameters, namely the amount of phosphoric acid (0.0–0.2%, w/w), the amount of water (1.0–5.0%, w/w), degumming temperature (30–70 °C), and degumming time (10–50 min). Optimum conditions for the minimum phosphorus level in the oil were found to be 0.15% phosphoric acid, 3.0% water, 40 °C degumming temperature, and 28 min degumming time, resulting in an almost complete removal of phosphorus. The final degummed wild almond oil had less than 1 mg kg⁻¹ phosphorus (reduced from an original value of 206 mg kg⁻¹). The experimental value of phosphorus reduction at optimum conditions agreed well with that predicted by the model. Peroxide value, anisidine value, iron, copper, and lead contents, phytosterols, unsaponifiable matter, and color of the oil decreased significantly during the degumming process; however, the fatty acid composition did not change. Also, degumming did not significantly impact the free fatty acid level, refractive index, density, iodine value, and the saponification value of the oil. However, tocopherols and the oxidative stability of the oil increased during degumming. Crude wild almond oil contained a trace level of amygdalin, which was completely eliminated during the degumming process.     

Macrophage-targeted single walled carbon nanotubes stimulate phagocytosis via pH-dependent drug release

Atherosclerotic cardiovascular disease is the leading cause of mortality in the world.A driving feature of atherosclerotic plaque formation is dysfunctional efferocytosis.Because the“don’t eat me”molecule CD47 is upregulated in atherosclerotic plaque cores,CD47-blocking strategies can stimulate the efferocytic clearance of apoptotic cells and thereby help prevent the progression of plaque buildup.However,these therapies are generally costly and,in clinical and murine trials,they have resulted in side effects including anemia and reticulocytosis.Here,we developed and characterized an intracellular phagocytosis-stimulating treatment in the CD47-SIRPαpathway.We loaded a novel monocyte/macrophage-selective nanoparticle carrier system with a small molecule enzymatic inhibitor that is released in a pH-dependent manner to stimulate macrophage efferocytosis of apoptotic cell debris via the CD47-SIRPαsignaling pathway.We demonstrated that single-walled carbon nanotubes(SWNTs)can selectively deliver tyrosine phosphatase inhibitor 1(TPI)intracellularly to macrophages,which potently stimulates efferocytosis,and chemically characterized the nanocarrier.Thus,SWNT-delivered TPI can stimulate macrophage efferocytosis,with the potential to reduce or prevent atherosclerotic disease.     

An efficient majority-based compressor for approximate computing in the nano era

Microsystem Technologies - Approximate computing is an effective paradigm for energy-efficient hardware design in nanoscale. In this study, an efficient 4:2 compressor for approximate computing in...     

Oxytetracycline nanosensor based on poly-ortho-aminophenol/multi-walled carbon nanotubes composite film

Poly-ortho-aminophenol (PoAP) and multi-walled carbon nanotubes (MWCNTs) were deposited on the platinum electrode using cyclic voltammetry technique to form the Pt/PoAP/MWCNTs nanosensor for the electrochemical determination of oxytetracycline as analyte. This electrochemical nanosensor with good uniformity and high surface area was prepared in the presence of an ionic surfactant (sodium dodecyl sulfate) as electrolyte to suspend carbon nanotubes within the PoAP and improve the stability and electroactivity of the composite film. The surface morphology of the prepared nanosensor was characterized by scanning electron microscopy and showed a three-dimensional network structure. The influence of several parameters such as number of potential cycles, scan rate and pH of the solution on the electrochemical response of the resultant electrode was investigated. The prepared electrode functioned as a selective recognition element for oxytetracycline determination. It showed excellent electrochemical response to oxytetracycline at low oxidative potential in buffer solution of pH 2.0, with good stability and sensitivity. Under the optimal experimental conditions, the electrochemical response of the sensor was linear with respect to the concentration of oxytetracycline in a dynamic range of 0.2 μM–0.25 mM. The detection limit of the fabricated nanosensor was calculated as 0.10 μM (signal/noise = 3). This sensor was used successfully for the oxytetracycline determination in real samples with recoveries of 96.9–103.5 %.