573 research outputs found

    Fractional Kinetics Compartmental Models

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    Ellagic Acid as Green Corrosion Inhibitor: a Necessary Validation

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    Corrosion of metals is an unavoidable but controllable process. Among techniques developed to slow down or prevent metal deterioration the addition of small amount of inhibitors directly in the corrosive environment is a quite common strategy. In particular, among organic compounds effectively used as adsorption inhibitors (thanks to N, O and/or S atoms that act as anchoring groups for metal surface) only a few percentage belongs to the so called \u201cgreen inhibitor\u201d class. In this field most of the studies employ plant extracts being rich in phytochemical constituents considered to be potential eco-friendly corrosion inhibitors. However, the often extraordinary complexity of crude extracts makes difficult the rationalization of the inhibition mechanism. So, from a purely academic point of view, the study of pure compounds is often encouraged. Among potential green inhibitors our attention has been focused on ellagic acid (EA) that can be obtained by hydrolysis of ellagitannin contained in peels of pomegranate. Ellagic acid is a polyphenol having four phenolic and two lactone groups that should act like two and one couples of equivalent sites, respectively, due to the C2h molecular symmetry. Up to know the corrosion inhibition properties of EA was only marginally studied in literature, both theoretically and experimentally. However some reported results need to be validated because of discrepancies concerning some fundamental chemical physical features of the target acid, like i) solubility in pure water (9 mg/dm3 versus 1.2 g/dm3) and ii) pKa values for the two acid dissociation processes. For this purposes, using UV-Vis absorption spectroscopy, a mainly-aqueous medium was selected to assure homogeneity of the EA-based solution; after that the corrosion inhibition properties of ellagic acid toward mild steel was studied by weight loss measurements (according to ASTM G1 standard practice) and by electrochemical tests. Preliminary results performed in 1% v/v MeOH/H2O mixture with HCl 0.05 M point to potentially interesting inhibition effect even working with 1.0 1910\u20135 M EA (i.e., 3 mg/dm3)

    Mathematical Modeling of Biofilm Structures Using COMSTAT Data

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    Mathematical modeling holds great potential for quantitatively describing biofilm growth in presence or absence of chemical agents used to limit or promote biofilm growth. In this paper, we describe a general mathematical/statistical framework that allows for the characterization of complex data in terms of few parameters and the capability to (i) compare different experiments and exposures to different agents, (ii) test different hypotheses regarding biofilm growth and interaction with different agents, and (iii) simulate arbitrary administrations of agents. The mathematical framework is divided to submodels characterizing biofilm, including new models characterizing live biofilm growth and dead cell accumulation; the interaction with agents inhibiting or stimulating growth; the kinetics of the agents. The statistical framework can take into account measurement and interexperiment variation. We demonstrate the application of (some of) the models using confocal microscopy data obtained using the computer program COMSTAT

    Creep, Relaxation and Viscosity Properties for Basic Fractional Models in Rheology

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    The purpose of this paper is twofold: from one side we provide a general survey to the viscoelastic models constructed via fractional calculus and from the other side we intend to analyze the basic fractional models as far as their creep, relaxation and viscosity properties are considered. The basic models are those that generalize via derivatives of fractional order the classical mechanical models characterized by two, three and four parameters, that we refer to as Kelvin-Voigt, Maxwell, Zener, anti-Zener and Burgers. For each fractional model we provide plots of the creep compliance, relaxation modulus and effective viscosity in non dimensional form in terms of a suitable time scale for different values of the order of fractional derivative. We also discuss the role of the order of fractional derivative in modifying the properties of the classical models.Comment: 41 pages, 8 figure

    Bioactive Phenolic Compounds From Agri-Food Wastes : An Update on Green and Sustainable Extraction Methodologies

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    Phenolic compounds are broadly represented in plant kingdom, and their occurrence in easily accessible low-cost sources like wastes from agri-food processing have led in the last decade to an increase of interest in their recovery and further exploitation. Indeed, most of these compounds are endowed with beneficial properties to human health (e.g., in the prevention of cancer and cardiovascular diseases), that may be largely ascribed to their potent antioxidant and scavenging activity against reactive oxygen species generated in settings of oxidative stress and responsible for the onset of several inflammatory and degenerative diseases. Apart from their use as food supplements or as additives in functional foods, natural phenolic compounds have become increasingly attractive also from a technological point of view, due to their possible exploitation in materials science. Several extraction methodologies have been reported for the recovery of phenolic compounds from agri-food wastes mostly based on the use of organic solvents such as methanol, ethanol, or acetone. However, there is an increasing need for green and sustainable approaches leading to phenolic-rich extracts with low environmental impact. This review addresses the most promising and innovative methodologies for the recovery of functional phenolic compounds from waste materials that have appeared in the recent literature. In particular, extraction procedures based on the use of green technologies (supercritical fluid, microwaves, ultrasounds) as well as of green solvents such as deep eutectic solvents (DES) are surveyed

    A stochastic model for internal HIV dynamics

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    In this paper we analyse a stochastic model representing HIV internal virus dynamics. The stochasticity in the model is introduced by parameter perturbation which is a standard technique in stochastic population modelling. We show that the model established in this paper possesses non-negative solutions as this is essential in any population dynamics model. We also carry out analysis on the asymptotic behaviour of the model. We approximate one of the variables by a mean reverting process and nd out the mean and variance of this process. Numerical simulations conclude the paper

    6-[(E)-3,7-Dimethyl­octa-2,6-dien­yl]-5,7-dihydr­oxy-8-(2-methyl­butano­yl)-4-phenyl-2H-chromen-2-one from Mesua kunstleri King (Kosterm)

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    The title compound, C30H34O5, crystallizes with two symmetry-independent mol­ecules in the asymmetric unit. In the crystal structure, the two independent mol­ecules are disposed about a pseudo-center of inversion. An intra­molecular O—H⋯O hydrogen bond is observed in each independent mol­ecule. The crystal structure is stabilized by C—H⋯O hydrogen bonds

    Green Corrosion Inhibitors from Natural Sources and Biomass Wastes

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    Over the past decade, green chemistry has been emphasizing the importance of protecting the environment and human health in an economically beneficial manner aiming at avoiding toxins and reducing wastes. The field of metallic materials degradation, generally faced by using toxic compounds, found a fertile research field in green chemistry. In fact, the use of inhibitors is a well-known strategy when metal corrosion needs to be prevented, controlled, or retarded. Green inhibitors are biodegradable, ecologically acceptable and renewable. Their valorization expands possible applications in industrial fields other than \u2018waste to energy\u2019 in the perspective of circular economy. Although lot of experimental work has been done and many research papers have been published, the topic of green inhibitors is still an open issue. The great interest in the field expanded the research, resulting in high numbers of tested molecules. However, the most frequently adopted approaches are conventional and, hence, not suitable to fully characterize the potential efficacy of inhibitors. All the mentioned aspects are the object of the present review and are meant as a constructive criticism to highlight the weak points of the green inhibitors field as to re-evaluate the literature and address the future research in the field that still lacks rationalization

    Tetrahydrohyperforin and Octahydrohyperforin Are Two New Potent Inhibitors of Angiogenesis

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    We have previously shown that hyperforin, a phloroglucinol derivative found in St. John's wort, behaves as a potent anti-angiogenic compound. To identify the reactive group(s) mainly involved in this anti-angiogenic effect, we have investigated the anti-angiogenic properties of a series of stable derivatives obtained by oxidative modification of the natural product. In addition, in the present work we have studied the role of the four carbonyl groups present in hyperforin by investigating the potential of some other chemically stable derivatives.The experimental procedures included the analysis of the effects of treatment of endothelial cells with these compounds in cell growth, cell viability, cell migration and zymographic assays, as well as the tube formation assay on Matrigel. Our study with hyperforin and eight derivatives shows that the enolized beta-dicarbonyl system contained in the structure of hyperforin has a dominant role in its antiangiogenic activity. On the other hand, two of the tested hyperforin derivatives, namely, tetrahydrohyperforin and octahydrohyperforin, behave as potent inhibitors of angiogenesis. Additional characterization of these compounds included a cell specificity study of their effects on cell growth, as well as the in vivo Matrigel plug assay.These observations could be useful for the rational design and chemical synthesis of more effective hyperforin derivatives as anti-angiogenic drugs. Altogether, the results indicate that octahydrohyperforin is a more specific and slightly more potent antiangiogenic compound than hyperforin
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