Modeling the Solubility of Monoterpenoids with Hybrid and Predictive Thermodynamic Tools.

The Abraham and NRTL-SAC semipredictive models were employed to represent the solubility of (-)-borneol, (1R)-(+)-camphor, l-(-)-menthol, and thymol in water and organic solvents, using data measured in this work and collected from the literature. A reduced set of solubility data was used to estimate the model parameters of the solutes, and global average relative deviations (ARDs) of 27% for the Abraham model and 15% for the NRTL-SAC model were obtained. The predictive capability of these models was tested by estimating the solubilities in solvents not included in the correlation step. Global ARDs of 8% (Abraham model) and 14% (NRTL-SAC model) were obtained. Finally, the predictive COSMO-RS model was used to describe the solubility data in organic solvents, with ARD of 16%. These results show the overall better performance of NRTL-SAC in a hybrid correlation/prediction approach, while COSMO-RS can produce very satisfactory predictions even in the absence of any experimental data.

The Role of the Anion in Imidazolium-Based Ionic Liquids for Fuel and Terpenes Processing.

The potentialities of methylimidazolium-based ionic liquids (ILs) as solvents were evaluated for some relevant separation problems-terpene fractionation and fuel processing-studying selectivities, capacities, and solvent performance indices. The activity coefficients at infinite dilution of the solute (1) in the IL (3), γ13∞, of 52 organic solutes were measured by inverse gas chromatography over a temperature range of 333.2-453.2 K. The selected ILs are 1-butyl-3-methylimidazolium hexafluorophosphate, [C4mim][PF6], and the equimolar mixture of [C4mim][PF6] and 1-butyl-3-methylimidazolium chloride, [C4mim]Cl. Generally, low polar solutes follow γ1,C4mimCl∞ > γ1,C4mimPF6+C4mimCl∞ > γ1,C4mimPF6∞ while the opposite behavior is observed for alcohols and water. For citrus essential oil deterpenation, the results suggest that cations with long alkyl chains, such as C12mim+, promote capacity, while selectivity depends on the solute polarity. Promising results were obtained for the separation of several model mixtures relevant to fuel industries using the equimolar mixture of [C4mim][PF6] and [C4mim]Cl. This work demonstrates the importance of tailoring the polarity of the solvents, suggesting the use of ILs with mixed anions as alternative solvents for the removal of aliphatic hydrocarbons and contaminants from fuels.

Dispositivos anticaídas en cuidados intensivos pediátricos: descripción de una experiencia exitosa de innovación liderada por enfermería en un hospital de cuidado terciario en Colombia / Anti Falls Device in Pediatric Intensive Care: Description of a Successful Innovative Experience Led by Nursing Personnel in Tertiary Hospital Care in Colombia / Dispositivo antiqueda em terapia intensiva pediátrica: descrição de uma experiência bemsucedida de inovação liderada pela enfermagem em um hospital de cuidado terciário na Colômbia

Introducción. Las caídas son eventos adversos que ponen en riesgo la integridad de quien las sufre. A pesar de la evidencia limitada sobre su efectividad, se han implementado algunos dispositivos de limitación de movimiento restrictivos y no restrictivos para prevenir caídas en niños críticamente enfermos en cuidados intensivos. Este artículo tiene como objetivo describir el diseño de un arnés preventivo y no restrictivo de movimiento para caídas intrahospitalarias en niños denominado "canguro-anticaídas", creado por profesionales de enfermería en una unidad de cuidados intensivos cardiovasculares pediátricos de la Fundación Cardioinfantil ­ Instituto de Cardiología. Tema de reflexión. A través de un enfoque reflexivo se presenta una descripción del dispositivo, los materiales, el método de uso, el personal que lo administra, los criterios de elegibilidad, la implementación del dispositivo, el alcance y la percepción del personal y los familiares respecto a su uso. Conclusiones. La prevención de caídas en población pediátrica hospitalizada en unidades de cuidados intensivos es uno de los pilares de la seguridad del paciente. La construcción de un dispositivo anticaída aplicado a esta población es una estrategia novedosa diseñada por el personal de enfermería para responder a la mejora continua de la calidad de la atención institucional. Palabras clave: Niños; Accidentes por Caídas; Prevención de Accidentes; Profesionales de Enfermería Pediátrica; Restricción Física; Difusión de Innovaciones; Unidades de Cuidado Intensivo Pediátrico

Introduction. Falls are adverse events that risk the integrity of those who suffer from them. Despite the limited evidence of its effectiveness, some restrictive and non-restrictive movement limitation devices have been implemented to prevent falls in critically ill children in intensive care. This article aims to describe the design of a preventive and non-restrictive movement harness for intra-hospital falls in children called "kangaroo- antifall", created by nursing professionals in a pediatric cardiovascular intensive care unit at the Cardioinfantil Foundation-Cardiology Institute. Reflection topics. Through a reflective approach, a description of the device materials, method of use, personnel who administer it, eligibility criteria, implementation of the device, scope, and perception of personnel and family members regarding its use are presented. Conclusions. One pillar of patient safety is fall prevention in pediatric populations hospitalized in intensive care units. The construction of an anti-fall device applied to this population is an innovative strategy designed by nursing staff to answer the continuous quality improvement of institutional care. Keywords: Child; Accidental Falls; Accident Prevention; Pediatric Nurse Practitioners; Restraint, Physical; Diffusion of Innovation; Intensive Care Units, Pediatric

Introdução. As quedas são eventos adversos que colocam em risco a integridade de quem sofre. A pesar das evidências limitadas sobre a sua eficácia, alguns dispositivos restritivos e não restritivos de limitação de movimento foram implementados para prevenir quedas em crianças gravemente doentes em cuidados intensivos. Este manuscrito tem como objetivo descrever o desenho de um arnês preventivo e sem restrição de movimento para quedas intra-hospitalares em crianças denominado "canguru-proteção contra quedas", criado por profissionais de enfermagem de uma unidade de terapia intensiva cardiovascular pediátrica da Fundação Cardioinfantil ­ Instituto de Cardiología. Tema de reflexão. Através de uma abordagem reflexiva, são apresentadas a descrição do dispositivo, materiais, método de uso, pessoal que o administra, critérios de elegibilidade, implementação do dispositivo, abrangência e percepción do pessoal e familiares sobre seu uso. Conclusões. A prevenção de quedas em populações pediátricas internadas em unidades de cuidados intensivos é um dos pilares da segurança do paciente. A construção de um dispositivo anti-queda aplicado a esta população é uma nova estratégia desenhada pela equipe de enfermagem para responder à melhoria contínua na qualidade do atendimento institucional. Palavras-chave: Crianças; Acidentes por Quedas; Prevenção de Acidentes; Profissionais de Enfermagem Pediátrica; Restrição Física; Difusão de Inovações; Unidades de Terapia Intensiva Pediátrica

Solubilities of Amino Acids in Aqueous Solutions of Chloride or Nitrate Salts of Divalent (Mg2+ or Ca2+) Cations.

The solubilities of glycine, l-leucine, l-phenylalanine, and l-aspartic acid were measured in aqueous MgCl2, Mg(NO3)2, CaCl2,, and Ca(NO3)2 solutions with concentrations ranging from 0 to 2 mol/kg at 298.2 K. The isothermal analytical method was used combined with the refractive index measurements for composition analysis guaranteeing good accuracy. All salts induced a salting-in effect with a higher magnitude for those containing the Ca2+ cation. The nitrate anions also showed stronger binding with the amino acids, thus increasing their relative solubility more than the chloride anions. In particular, calcium nitrate induces an increase in the amino acid solubility from 2.4 (glycine) to 4.6 fold (l-aspartic acid) compared to the corresponding value in water. Amino acid solubility data in aqueous MgCl2 and CaCl2 solutions collected from the open literature were combined with that from this work, allowing us to analyze the relations between the amino acid structure and the salting-in magnitude.

Imidazolium Chloride Ionic Liquid Mixtures as Separating Agents: Fuel Processing and Azeotrope Breaking.

Relevant chemical separations for the petrochemical and chemical industries include the removal of aromatic hydrocarbons from aliphatics, the desulfurization and denitrification of fuels, and the separation of azeotropic mixtures containing alkanols. In an attempt to contribute to the development of novel technologies, the potentialities of imidazolium chloride ionic liquid (IL) mixtures as separation agents were investigated. Selectivities, capacities, and solvent performance indices were calculated through the activity coefficients at infinite dilution of organic solutes and water in the imidazolium chloride IL: [C8mim]Cl, [C12mim]Cl, and the equimolar mixture of [C4mim]Cl and [C12mim]Cl. Results show that the imidazolium chloride IL might be appropriately tailored for specific purposes, in which an increase in the proportion of cations containing larger alkyl chains tends to increase the overall affinity with organic solutes. The IL designer solvent concept was explored by comparing the IL equimolar mixture results with the intermediary [C8mim]Cl. The COSMO-RS thermodynamic model was also applied, showing it to be a promising tool for a fast qualitative screening of potential separation agents for specific separation processes.

Extensive characterization of choline chloride and its solid-liquid equilibrium with water.

The importance of choline chloride (ChCl) is recognized due to its widespread use in the formulation of deep eutectic solvents. The controlled addition of water in deep eutectic solvents has been proposed to overcome some of the major drawbacks of these solvents, namely their high hygroscopicities and viscosities. Recently, aqueous solutions of ChCl at specific mole ratios have been presented as a novel, low viscous deep eutectic solvent. Nevertheless, these proposals are suggested without any information about the solid-liquid phase diagram of this system or the deviations from the thermodynamic ideality of its precursors. This work contributes significantly to this matter as the phase behavior of pure ChCl and (ChCl + H2O) binary mixtures was investigated by calorimetric and analytical techniques. The thermal behavior and stability of ChCl were studied by polarized light optical microscopy and differential scanning calorimetry, confirming the existence of a solid-solid transition at 352.2 ± 0.6 K. Additionally, heat capacity measurements of pure ChCl (covering both ChCl solid phases) and aqueous solutions of ChCl (xChCl < 0.4) were performed using a heat-flow differential scanning microcalorimeter or a high-precision heat capacity drop calorimeter, allowing the estimation of a heat capacity change of (ChCl) ≈ 39.3 ± 10 J K-1 mol-1, between the hypothetical liquid and the observed crystalline phase at 298.15 K. The solid-liquid phase diagram of the ChCl + water mixture was investigated in the whole concentration range by differential scanning calorimetry and the analytical shake-flask method. The phase diagram obtained for the mixture shows an eutectic temperature of 204 K, at a mole fraction of choline chloride close to xChCl = 0.2, and a shift of the solid-solid transition of ChCl-water mixtures of 10 K below the value observed for pure choline chloride, suggesting the appearance of a new crystalline structure of ChCl in the presence of water, as confirmed by X-ray diffraction. The liquid phase presents significant negative deviations to ideality for water while COSMO-RS predicts a near ideal behaviour for ChCl.

Monitoring environmental conditions on the speed of development and larval migration of gastrointestinal nematodes in Urochloa decumbens in northeastern Brazil.

The study aimed to evaluate the speed of development of gastrointestinal nematodes (GIN) eggs to infective larvae (L3) and its migration under effect of meteorological variables: temperature, rainfall, relative humidity, solar radiation to Urochloa (=Brachiaria) decumbens grass pasture during rainy season, from June to September 2019, and dry season, October to March 2020, in Recôncavo baiano region of Bahia state, Brazil. Monthly, fecal samples obtained from goats with recurrent GIN infection were deposited in six plots of one square meter. In +7, +14 and + 21-days post-deposition, lower and upper strata grass (0-15 and > 15 cm, respectively) and remaining feces were collected and submitted to Baermann's technique modified to perform larval count and identification. Meteorological data were obtained from a local weather station database. The log-transformed larval count results were analyzed regarding the collection day effect, stratum effect, comparing the means by Tukey's test (p < 0.05). Multivariate regression analysis and correlation of meteorological variables with larval counts was performed. In the rainy season, the largest proportion of recovered L3 was concentrated in +7-days post-deposition in the months of June and July, both in the remaining feces and herbage samples, while in August development took place more slowly, after +14-days post-deposition. During the dry season, L3 development only occurred after the first collection in January and February. Lower strata had higher proportion of recovery than in upper strata. Negative correlation was found for solar radiation. Greater rainfall in the rainy season compared to dry season was a favorable condition for high contamination of grass samples. However, reduced vertical migration to upper strata may have been influenced by low temperatures during the rainy season. Regarding the genera present in the fecal samples used in the experiment were found Haemonchus sp., Trichostrongylus sp. and Oesophagostomum sp. Thus, it is possible to conclude that in the region of the study, during the rainy season, there is a rapid larval development and the L3 are able to migrate more effectively to the grass. On the other hand, in the dry season, larval development tends to be slower, with less migration to the grass. Solar radiation can be useful for predicting months with the highest risk of infection. Therefore, prophylactic measures should be employed in goat herds during the rainy season whilst natural reduced pasture contamination in the dry season may favor animal maintenance for a longer time.

Liquefying Flavonoids with Terpenoids through Deep Eutectic Solvent Formation.

The formation of deep eutectic solvents (DES) is tied to negative deviations to ideality caused by the establishment of stronger interactions in the mixture than in the pure DES precursors. This work tested thymol and menthol as hydrogen bond donors when combined with different flavonoids. Negative deviations from ideality were observed upon mixing thymol with either flavone or flavanone, two parent flavonoids that only have hydrogen bond acceptor (HBA) groups, thus forming non-ionic DES (Type V). On the other hand, the menthol systems with the same compounds generally showed positive deviations from ideality. That was also the case with the mixtures containing the more complex hydroxylated flavonoid, hesperetin, which resulted in positive deviations when mixed with either thymol or menthol. COSMO-RS successfully predicted the behavior of the solid-liquid phase diagram of the studied systems, allowing for evaluation of the impact of the different contributions to the intermolecular interactions, and proving to be a good tool for the design of DES.

Valorization of Juglans regia Leaves as Cosmeceutical Ingredients: Bioactivity Evaluation and Final Formulation Development.

The cosmetic industry is constantly searching for bioactive ingredients, namely, those obtained from natural sources with environmentally friendly connotations and less toxic effects. A previous study of our research group optimized the extraction of phenolic compounds from Juglans regia by heat-assisted extraction. Due to its richness in different phenolic compounds, the present work aimed to develop a formulation containing J. regia leaf extract. The extract's antioxidant, anti-tyrosinase, antimicrobial, anti-inflammatory, wound healing, cytotoxicity, and photostability properties were evaluated. The extract was then incorporated into an O/W base cream, followed by characterization of the final formulation in terms of its antioxidant properties, phenolic composition, and stability over time and at different storage conditions. The most abundant compounds in the hydroethanolic extract were 3-O-caffeoylquinic acid (18.30 ± 0.04 mg/g), quercetin-O-pentoside (9.64 ± 0.06 mg/g), and quercetin 3-O-glucoside (6.70 ± 0.19 mg/g). Besides those, the extract presented antioxidant, anti-inflammatory, wound closure, and antibacterial effects against several skin pathogens. In addition, HaCaT cell viability was maintained up to 98% at 400 µg/mL. Within Proteus vulgaris-infected HaCaT cells, the extract also presented an over 40% bacterial mortality rate at its nontoxic concentration (200 µg/mL). After incorporating the extract, the obtained formulation presented a good physicochemical profile over time and at different storage conditions while also maintaining its antioxidant effect; as such, it can be considered stable for topical application. Future work to evaluate its performance in terms of skin permeation and detailed toxicological studies with a focus on regulatory requirements, involving skin irritation, eye irritation, genotoxicity, photo-irritation, and dermal absorption, should be conducted, as the prepared formulation demonstrated relevant properties that deserve to be further explored.

Comparison of two computational methods for solvent screening in countercurrent and centrifugal partition chromatography.

Countercurrent and centrifugal partition chromatography are techniques applied in the separation and isolation of compounds from natural extracts. One of the key design parameters of these processes is the selection of the biphasic solvent system that provides for the adequate partitioning of the solutes. To address this challenging task, the fully predictive Conductor-like Screening Model for Real Solvents (COSMO-RS) and the semi-predictive Non-Random Two-Liquid Segment Activity Coefficient (NRTL-SAC) model were applied to estimate the partition coefficients (K) of four model phenolic compounds (vanillin, ferulic acid, (S)-hesperetin and quercetin) in different solvent systems. Complementing the experimental data collected in the literature, partition coefficients of each solute in binary, or quaternary, solvent systems were measured at 298.2 K. Higher deviations from the experimental data were obtained using the predictive COSMO-RS model, with an average RMSD (root-mean-square deviation) in log(K) of 1.17 of all four solutes (61 data points), providing a satisfactory quantitative description only for the systems containing vanillin (RSMD = 0.57). For the NRTL-SAC model, the molecular parameters of the solutes were initially calculated by correlating a set of K and solubility (x, in mole fraction) data (16 partition coefficients and 44 solubility data points), for which average RMSD values of 0.07 and 0.41 were obtained in log(K) and log(x), respectively. The predictions of the remaining log(K) data (45 partition coefficients) resulted in an average RMSD of 0.43, suggesting that the NRTL-SAC model was a more reliable quantitative solvent screening tool. Depending on the amount of available solubility and partition data, both models can be valuable alternatives in the preliminary stages of solvent screening destined to select the optimal mobile and stationary phases for a given separation.

Dataset for the synthesis, characterisation and application of cobalt and nitrogen co-doped TiO2 anatase nanoparticles on triclosan photodegradation using visible LED light.

The growing threat of emerging waterborne contaminants is a global concern, fuelled in part by the ineffectiveness of current remediation strategies. One of the most prominent remediation strategies is catalytic photodegradation, particularly with TiO2 nanoparticles (NPs), but its full utilization is hampered by using only UV radiation, which is scarce in sunlight. To fully benefit from the sunlight abundance, several efforts are focused on the tailoring of TiO2 to make it more active in visible (Vis) light. However, this target is yet to be met, sought for new developments. In a recent research paper entitled "Visible light-driven photodegradation of triclosan and antimicrobial activity against Legionella pneumophila with cobalt and nitrogen co-doped TiO2 anatase nanoparticles" [ 1 ], we investigated the co-doping potential of cobalt and nitrogen in TiO2 NPs for water decontamination, focusing on its application for the degradation of triclosan (TCS) under Vis LED light irradiation. Herein, the synthesis methodology for the preparation of doped TiO2 with nitrogen is described in detail, along with complementary data on the characterisation of all previously synthesised photocatalysts in the form of specific surface area determination (B.E.T. method) based on the obtained physisorption isotherms, X-ray photoelectron spectroscopy (XPS), and the automatic determination of bandgap energy through the diffuse reflectance spectra (DRS) analysis by using the GapExtractor© software. This dataset article also includes optimised photocatalytic reaction conditions, specifically conducted under monochromatic LED light irradiation. The employed LED irradiation conditions can support photocatalytic research in the field, since LED systems are costless and have a long-life span compared to most conventional UV-Vis systems. In addition, raw UV-Vis spectra and high-performance liquid chromatography (HPLC) chromatograms for monitoring the TCS degradation reaction are also included, as are powder X-ray diffractograms (XRD) of recycled doped-TiO2 photocatalysts, confirming the renewable efficiency of the synthesised photocatalysts to pursue green chemistry principles.

A Brief Evaluation of Antioxidants, Antistatics, and Plasticizers Additives from Natural Sources for Polymers Formulation.

The circular economy plays an important role in the preparation and recycling of polymers. Research groups in different fields, such as materials science, pharmaceutical and engineering, have focused on building sustainable polymers to minimize the release of toxic products. Recent studies focused on the circular economy have suggested developing new polymeric materials based on renewable and sustainable sources, such as using biomass waste to obtain raw materials to prepare new functional bio-additives. This review presents some of the main characteristics of common polymer additives, such as antioxidants, antistatic agents and plasticizers, and recent research in developing bio-alternatives. Examples of these alternatives include the use of polysaccharides from agro-industrial waste streams that can be used as antioxidants, and chitosan which can be used as an antistatic agent.

Extraction of Aloesin from Aloe vera Rind Using Alternative Green Solvents: Process Optimization and Biological Activity Assessment.

Aloesin is an aromatic chromone with increasing applications in the cosmetic and health food industries. To optimize its extraction from the Aloe vera leaf rind, the independent variables time (10-210 min), temperature (25-95 °C) and organic solvent composition (0-100%, w/w) were combined in a central composite design coupled with response surface methodology. The solvents consisted of binary mixtures of water with ethanol, propylene glycol, or glycerol. The aloesin levels quantified in each extract were used as response for optimization. The theoretical models were fitted to the experimental data, statistically validated, and used to obtain the optimal extraction conditions. Then, a dose-response analysis of the solid/liquid ratio (S/L) was performed under the optimal conditions determined for each alcohol-water system and revealed that a linear improvement in extraction efficiency can be achieved by increasing the S/L ratio by up to 40 g/L. This analysis also allowed to experimentally validate the predictive models. Furthermore, the aloesin-rich extracts revealed antioxidant activity through thiobarbituric acid reactive substances (TBARS) formation inhibition, antimicrobial effects against bacterial and fungal strains, and no toxicity for PLP2 cells. Overall, this study provided optimal extraction conditions for the recovery of aloesin from Aloe vera rind through an eco-friendly extraction process and highlighted its bioactive potential.

Assessment of the environmental compatibility and antifouling performance of an innovative biocidal and foul-release multifunctional marine coating.

The control of marine biofouling has raised serious environmental concerns, thus the continuous release of toxic and persistent biocidal agents applied as anti-biofouling coatings have triggered the search for non-toxic strategies. However, most of them still lack rigorous evaluation of their ecotoxicity and antifouling effects under real scenarios and their correlation with simulated assays. In this work, the biocide releasing risk and ecotoxicity of a biocidal and foul-release polydimethylsiloxane (PDMS)-based marine coating containing grafted Econea biocide (<0.6 wt.%) were evaluated under simulated real mechanical wear conditions at a pilot-scale system, and under extreme wear scenarios (washability settings). The coating system demonstrated low environmental impact against the model Vibrio fischeri bacterium and marine algae, associated with the effective biocide grafting in the coating matrix and subsequent biocide release minimization. This multifunctional coating system also showed auspicious antifouling (AF) effects, with an AF performance index significantly higher (API > 89) than a single foul-release system (AF < 40) after two and half years at a real immersion scenario in the Portuguese shore of the Atlantic Ocean. These field results corroborated the antibiofilm performance evaluated with Pseudoalteromonas tunicata at simulated dynamic marine conditions after seven-week assays. This eco-friendly multifunctional strategy, validated by both simulated testing conditions and real field tests, is believed to be a powerful tool for the development of AF technologies and a potential contribution to the quest for new environmentally friendly antifouling solutions.

Insights on the Extraction Performance of Alkanediols and Glycerol: Using Juglans regia L. Leaves as a Source of Bioactive Compounds.

Glycerol and alkanediols are being studied as alternative solvents to extract phytochemicals from plant material, often as hydrogen bond donors in deep eutectic solvents (DESs). Many of those alcohols are liquid at room temperature, yet studies of their use as extraction solvents are scarce. In this work, glycerol and a series of alkanediols (1,2-ethanediol, 1,2-propanediol, 1,3-propanediol, 1,3-butanediol, 1,2-pentanediol, 1,5-pentanediol, and 1,2-hexanediol) were studied for the extraction of phenolic compounds from Juglans regia L. leaves, a rich source of this class of bioactive compounds. The extraction yield was quantified, and the bioactivity of both extracts and pure solvents was evaluated by measuring the anti-inflammatory and cytotoxic activities. The solvents showing the best combined results were 1,2 and 1,3-propanediol, as their extracts presented a high amount of phenolic compounds, close to the results of ethanol, and similar cytotoxicity against cervical carcinoma cells, with no impact on non-tumor porcine liver cells in the studied concentration range. On the other hand, none of the extracts (and solvents) presented anti-inflammatory activity. Overall, the results obtained in this work contribute to the study of alternative solvents that could potentially be used also as formulation media, highlighting the importance of walnut leaves as a source of bioactive compounds.

Hydroethanolic extract of Juglans regia L. green husks: A source of bioactive phytochemicals.

Juglans regia L. (walnut) green husks are an important fraction of waste resulting from the walnut production, thus representing an interesting natural matrix to explore as a source of bioactive compounds. In this work, the hydroethanolic extract of walnut green husks was studied considering the phytochemical composition and the biological activity using different cell model assays, most of them evaluated for the first time for this matrix. From the HPLC-DAD-ESI/MSn analysis, sixteen compounds were identified, being the extract mostly composed of naphthalene derivatives (including tetralone derivatives) and less abundant in phenolic compounds (hydroxycinnamic acids and flavonols). The cytotoxic potential of the extract was assessed against tumour (MCF-7, NCI-H460, HeLa and HepG2) and non-tumour (PLP2) cell lines. Moreover, the antioxidant activity of the extract was evaluated by inhibition of the oxidative haemolysis (OxHLIA) and the formation of thiobarbituric acid reactive substances (TBARS), and the anti-inflammatory potential by the inhibition of the NO production by the RAW264.7 cell culture. The antibacterial effects of the extract were also evaluated against Gram-negative and Gram-positive bacteria. The results obtained represent a stepping stone for the development of future applications using walnut green husks as a source of added value compounds with bioactive potential.

Investigations into the Structure/Antibacterial Activity Relationships of Cyclam and Cyclen Derivatives.

A series of cyclam- and cyclen-derived salts are described in the present work; they were designed specifically to gain insights into their structure and antibacterial activity towards Staphylococcus aureus and Escherichia coli, used respectively, as Gram-positive and Gram-negative model organisms. The newly synthesized compounds are monosubstituted and trans-disubstituted tetraazamacrocycles that display benzyl, methylbenzyl, trifluoromethylbenzyl, or trifluoroethylbenzyl substituents appended on the nitrogen atoms of the macrocyclic ring. The results obtained show that the chemical nature, polarity, and substitution patterns of the benzyl groups, as well as the number of pendant arms, are critical parameters for the antibacterial activity of the cyclam-based salts. The most active compounds against both bacterial strains were the trans-disubstituted cyclam salts displaying CF3 groups in the para-position of the aromatic rings of the macrocyclic pendant arms. The analogous cyclen species presents a lower activity, revealing that the size of the macrocyclic backbone is an important requirement for the antibacterial activity of the tetraazamacrocycles. The nature of the anionic counterparts present on the salts was found to play a minor role in the antibacterial activity.

Wells syndrome associated with lung cancer.

Wells syndrome (WS) or eosinophilic cellulitis is a rare, idiopathic, inflammatory dermatosis. The typical clinical presentation is urticarial plaque without preferential location that usually heals without scarring. We present a 62-year-old man with history of lung cancer that had undergone a right superior lobectomy 12 months previously. The patient had a relapsing dermatosis beginning about 6 months before the diagnosis of the lung cancer, characterised by pruritic, erythematous plaques located on the trunk and arms. These lesions spontaneously resolved within a few weeks without scarring. A skin biopsy revealed findings compatible with WS. Several diseases have been associated with WS. These include haematological diseases, fungal, parasitic and viral infections, drug reactions and rarely non-haematological malignancies. We present a case of this rare syndrome in a patient with history of lung cancer that we believe acted as a triggering event. To our knowledge, this is the second case reporting this association.