Rapid Parallel Synthesis of Bioactive Folded Cyclotides by Using a Tea‐Bag Approach

We report here the first rapid parallel production of bioactive folded cyclotides by using Fmoc‐based solid‐phase peptide synthesis in combination with a “tea‐bag” approach. Using this approach, we efficiently synthesized 15 analogues of the CXCR4 antagonist cyclotide MCo‐CVX‐5c. Cyclotides were synthesized in a single‐pot, cyclization/folding reaction in the presence of reduced glutathione. Natively folded cyclotides were quickly purified from the cyclization/folding crude mixture by activated thiol Sepharose‐based chromatography. The different folded cyclotide analogues were then tested for their ability to inhibit the CXCR4 receptor in a cell‐based assay. The results indicated that this approach can be used for the efficient chemical synthesis of libraries of cyclotides with improved biological properties that can be easily interfaced with solution or cell‐based assays for rapid screening.     

Modeling segregation of bidisperse granular materials using physical control parameters in the quasi‐2D bounded heap

Quantitatively predicting segregation of size‐disperse granular materials is of potential value in many industrial applications. We consider granular segregation of size‐bidisperse particles in quasi‐2D bounded heaps, a canonical granular flow, using an advection‐diffusion transport equation with an additional term to account for particle segregation. The equation is characterized by two dimensionless parameters that are functions of control parameters (flow rate, system size, and particle sizes) and kinematic parameters (flowing layer depth, diffusion coefficient, and percolation length scale). As the kinematic parameters are usually difficult to measure in practice, their dependence on the control parameters is determined directly from discrete element method simulations. Using these relationships, it is possible to determine which values of the control parameters result in a mixed or segregated heap. The approach used here is broadly applicable to a wide range of other flow geometries and particle systems. © 2015 American Institute of Chemical Engineers AIChE J, 61: 1524–1534, 2015     

Tuning rules for a quick start up in Dynamic Matrix Control

This paper pretends to offer design rules for the parameters adjustment of the Dynamic Matrix Control (DMC) to allow an easier starting up. The effect on the time response of each algorithm parameter that can be tuned by the user is studied in an unconstrained system. To this aim, the position of the closed loop poles of the equivalent system is calculated. To simplify the study and to obtain more direct conclusions the number of poles will be limited using a First Order Plus Death Time simplification of the real plant. Design rules proposed in this study are tested in some simulated benchmarks and in a real plant.     

Discrete-event simulation based performance quantification of web-based and traditional bidder inquiry processes

This paper describes an innovative application of discrete-event simulation to model and evaluate differences in business processes following the introduction of new information technologies. Validated models can be used by offices considering the new technology to calibrate existing work loads and then to predict the expected impact of new information technology on measurable business metrics. Following the introduction of the technology, this model may assist in the real-time verification of user paths incorporated in software support tools. This paper will be of interest to those evaluating the impact of information technology and public construction contract administration.     

Dweb model: Representing Web 2.0 dynamism

Due to the increase in the number and popularity of applications such as e-commerce or on-line booking systems, typical of the Web 2.0, dynamic contents are becoming more and more frequent. This trend suggests the review of widely accepted paradigms and models for the World Wide Web. As a system that is continuously changing, both in the offered applications and in its infrastructure, performance evaluation studies are a main concern to provide sound proposals when designing new web-related systems. Although the dynamism in the workload characterization has also been tackled in previous research, it has not been modeled in a precise way yet because of its complex nature.In this paper we propose the Dweb model which represents the dynamism of current web applications in the workload characterization. Dweb is based on three main concepts that allow to model dynamic workload: navigation, workload test and workload distribution. In addition, a dynamic workload generator has been implemented to show the practical application of the proposed model, which has been illustrated through a case study.     

Lipid Damage Inhibition in Hake by Active Packaging Film with Natural Antioxidants

The capacity of the natural antioxidant to retard oxidation of polyunsaturated fatty acids in hake (Merluccius merluccius) muscle was investigated. Hake fillets were packaged in low‐density polyethylene with the natural antioxidant (sample C1 = 7 mg/dm² film and sample C2 = 24 mg/dm² film) or without the antioxidant (control sample) and frozen for 12 months at ?20°C. The results confirm the efficacy of an active packaging with a natural antioxidant derived from barley husks to slow the progress of lipid hydrolysis and increase oxidative stability in hake muscle. Determination of peroxide value, conjugated dienes, free fatty acids, thiobarbituric acid reactive substances (TBARS) and anisidine value (AV) proved suitable for studying lipid hydrolysis and primary and secondary lipid oxidation over time. After 6 months of frozen storage, the TBARS levels were lower in hake packed with low‐density polyethylene with the natural antioxidant (C1 and C2) than in the control sample; at month 12, the TBARS values of C1 and C2 were lower (16 and 21%, respectively) than the control samples. AVs observed in samples C1 and C2 at month 9 were lower than those observed in the control sample at month 12. Copyright © 2011 John Wiley & Sons, Ltd.     

Rheological characterization of edible films made from collagen colloidal particle suspensions

A rheological characterization of collagen edible films is proposed through the experimental evaluation of shear elastic modulus, toughness, hydration capability and stress and stretch ratio at fracture. These properties are obtained from hydration, simple extension and compression tests and analyzed through the BST (Blatz, Sharda, & Tschoegl, 1974) hyperelastic model. Also precursor collagen particle suspensions, with solid concentrations in the range 0.5–4% w/w, are studied to evaluate their thixotropic responses in sudden imposed shear rates and shear loops. These responses are a consequence of particle aggregations leading to cluster formations. The particle size distribution function of suspensions is determined via scanning electron microscopy. Films are formed by casting and then fixed through either a coagulation process with a salt solution or a chemical process involving covalent cross-links with glutaraldehyde. Results indicate that these collagen films behave as colloidal particulate networks composed of particles and clusters. Also it is found that the fractal dimension of clusters is an intrinsic property of collagen particle suspensions, independently from the maturation time. Clusters in these suspensions are formed with a rather open architecture (low fractal value) due to rather large particle attractive forces. The evaluation of the BST rheological parameters allows one the estimation of the energy amount required to get film fracture for different collagen and cross-linker concentrations. Since the final films have to satisfy several quality requirements before using, the interplay between their stiffness and toughness is presented and discussed.     

Ultrasonic densitometer using a multiple reflection technique

This work presents recent improvements in a density measurement cell with a double-element transducer that can eliminate diffraction effects. A new mechanical design combined with the use of more appropriate materials has resulted in better parallelism between interfaces, more robust assembly, and chemical resistance. A novel method of signal processing, named the energy method, is introduced to obtain the reflection coefficient, reducing sensitivity to noise and improving accuracy. The measurement cell operation is verified both theoretically, using an acoustic wave propagation model, and experimentally, using homogeneous liquids with different densities. The accuracy in the density measurement is 0.2% when compared with the measurements made with a pycnometer.