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Keywords = free 25(OH)D

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13 pages, 1114 KiB  
Article
Vitamin D Supplementation for Children with Epilepsy on Antiseizure Medications: A Randomized Controlled Trial
by Fahad A. Bashiri, Abrar Hudairi, Muddathir H. Hamad, Lujain K. Al-Sulimani, Doua Al Homyani, Dimah Al Saqabi, Amal Y. Kentab and Reem A. Al Khalifah
Children 2024, 11(10), 1187; https://doi.org/10.3390/children11101187 - 28 Sep 2024
Cited by 2 | Viewed by 2605
Abstract
Background: Antiseizure medications (ASMs) are crucial for managing epilepsy in children. However, a well-documented side effect of ASMs is their impact on bone health, often due to interference with vitamin D metabolism. This can lead to vitamin D deficiency in children with epilepsy. [...] Read more.
Background: Antiseizure medications (ASMs) are crucial for managing epilepsy in children. However, a well-documented side effect of ASMs is their impact on bone health, often due to interference with vitamin D metabolism. This can lead to vitamin D deficiency in children with epilepsy. This study aimed to determine if a daily dose of 400 IU or 1000 IU would maintain adequate vitamin D levels in children with epilepsy. Methods: A phase IV randomized controlled trial enrolled children aged 2–16 years with epilepsy and receiving antiseizure medications. Children were divided into two groups: the monotherapy group, which was defined as children on one antiseizure medication (ASM), and the polytherapy group, which was defined as children receiving two or more ASMs. Eligible children with levels above 75 nmol/L were randomized to receive a maintenance dose of either 400 IU/day or 1000 IU/day of cholecalciferol. Baseline and 6-month assessments included demographic data, anthropometric measurements, seizure type, medications, seizure control, and 25(OH)D level. Results: Out of 163 children, 90 were on monotherapy and 25 on polytherapy. After 6 months of vitamin D maintenance, the proportion of children with 25(OH)D concentration below 75 nmol/L was 75.0% in the 400 IU group and 54.8% in the 1000 IU group. In the monotherapy group, baseline seizure-free children increased from 69% to 83.6% after treating vitamin D deficiency. Conclusion: Daily vitamin D supplementation with 1000 IU may be beneficial for children with epilepsy, particularly those receiving monotherapy, to maintain sufficiency and potentially improve seizure control. Full article
(This article belongs to the Section Pediatric Neurology & Neurodevelopmental Disorders)
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28 pages, 6467 KiB  
Article
Photo(solar)-Activated Hypochlorite Treatment: Radicals Analysis Using a Validated Model and Assessment of Efficiency in Organic Pollutants Degradation
by Hayet Amichi, Slimane Merouani, Aissa Dehane, Hana Bouchoucha and Oualid Hamdaoui
Processes 2024, 12(9), 1853; https://doi.org/10.3390/pr12091853 - 30 Aug 2024
Cited by 1 | Viewed by 1656
Abstract
Reactive oxygen species (ROS) and reactive chlorine species (RCS) and their involvement in the degradation process are explored in this work by thorough kinetic modeling of the solar-activated hypochlorite degradation of Rhodamine B (RhB) dye. The kinetic modeling enabled the determination of rate [...] Read more.
Reactive oxygen species (ROS) and reactive chlorine species (RCS) and their involvement in the degradation process are explored in this work by thorough kinetic modeling of the solar-activated hypochlorite degradation of Rhodamine B (RhB) dye. The kinetic modeling enabled the determination of rate constants for both radical and non-radical pathways of hypochlorite and the oxidation of RhB by free radicals. Using COPASI® software, fed with a kinetics mechanism of 144 chemical reactions, the free radical kinetic model accurately fitted experimental data under various conditions, including temperatures ranging from 25 to 55 °C and initial hypochlorite concentrations from 300 to 1000 µM, at a controlled pH of 11. Results indicate that increasing hypochlorite dosages and temperatures enhance free radical concentrations and RhB degradation rates. OH and ClO radicals were quantified as primary contributors to RhB degradation, while ozone played a minor role. The model provides profiles for ROS and RCS, details on radicals distribution in RhB degradation, and predictions of rate constants for the photolysis of ClO: kR1 = 2.67 × 10−4 s−1 for the radical pathway (ClO hν O•− + Cl), and kR2 = 1.88 × 10−5 s−1 and kR3 = 0 s−1 for the non-radical pathway (i.e., ClO hν O(3P) + Cl and ClO hν O(1D) + Cl, respectively). The rate constants for RhB reactions with O•−, Cl, Cl2•− and ClO were predicted to be 4.8 × 109 M−1 s−1, 1.45 × 109 M−1 s−1, 2.5 × 107 M−1 s−1 and 8.7 × 104 M−1 s−1, respectively. Lower rate constants were predicted for RhB reactions with HOCl•−, HO2, O2•−, and O(3P), with values of 4.1 × 104 M−1 s−1, 7.3 × 105 M−1 s−1, 3.6 × 104 M−1 s−1, and 0.40 M−1 s−1, respectively. Full article
(This article belongs to the Special Issue Treatment and Remediation of Organic and Inorganic Pollutants)
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16 pages, 10153 KiB  
Article
Effect of Temperature and NaClO on the Corrosion Behavior of Copper in Synthetic Tap Water
by Fei Sun, Na Zhang, Shen Chen and Moucheng Li
Metals 2024, 14(5), 543; https://doi.org/10.3390/met14050543 - 3 May 2024
Cited by 3 | Viewed by 2129
Abstract
The corrosion behavior of copper was investigated in synthetic tap water with and without sodium hypochlorite (NaClO) at different temperatures during immersion for 70 d by using scanning electron microscopy (SEM), X-ray diffraction (XRD), and electrochemical measurement techniques. The weight loss corrosion rate [...] Read more.
The corrosion behavior of copper was investigated in synthetic tap water with and without sodium hypochlorite (NaClO) at different temperatures during immersion for 70 d by using scanning electron microscopy (SEM), X-ray diffraction (XRD), and electrochemical measurement techniques. The weight loss corrosion rate and pit depth of copper first increase and then decrease with the change in solution temperature from 25 to 80 °C. This is mainly related to the corrosion products formed on the copper surface. The main corrosion products change from Cu2O and Cu2(OH)2CO3 to CuO with the increase in solution temperature. The presence of 3 ppm NaClO slightly increases the weight loss corrosion rate and pit depth of copper under all temperatures except for 50 °C and reduces the temperature of the maximum corrosion rate from 50 to 40 °C. Free chlorine reduction accelerates the cathodic reaction of the corrosion process. Full article
(This article belongs to the Section Corrosion and Protection)
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17 pages, 6187 KiB  
Article
Three-Dimensional Electrode-Enhanced Ozone Catalytic Oxidation for Thiamethoxam Wastewater Treatment: Performance, Kinetics, and Pathway
by Weijie Zhou, Jibo Xiao, Xiang Jiang, Jianchao Su, Shuyi Chu, Xiao Ma and Jun Li
Catalysts 2024, 14(4), 245; https://doi.org/10.3390/catal14040245 - 7 Apr 2024
Cited by 2 | Viewed by 1766
Abstract
Thiamethoxam is a second-generation neonicotinoid pesticide that is used worldwide. In this study, a three-dimensional electrode-enhanced ozone catalytic oxidation system (3DE-GAC-O3) was constructed to pretreat thiamethoxam wastewater, with granular active carbon as the particle electrode. The effects of catalytic oxidation time, [...] Read more.
Thiamethoxam is a second-generation neonicotinoid pesticide that is used worldwide. In this study, a three-dimensional electrode-enhanced ozone catalytic oxidation system (3DE-GAC-O3) was constructed to pretreat thiamethoxam wastewater, with granular active carbon as the particle electrode. The effects of catalytic oxidation time, current density, ozone concentration, initial thiamethoxam concentration, pH, and particle electrode dosage on thiamethoxam degradation were investigated. A response surface method based on the Box–Behnken design was employed to optimize the 3DE-GAC-O3 process. The results revealed that the 3DE-GAC-O3 system exhibited higher efficiency compared with the 3D electrode method, ozone catalytic oxidation, or 2DE-O3. The optimal operating conditions included a particle electrode dosage, ozone concentration, current density, solution pH, catalytic oxidation time, and initial thiamethoxam concentration of 18 g/dm3, 12 g/h, 25 A/m2, 7, 300 min, and 500 mg/dm3, respectively. The corresponding chemical oxygen demand removal rate reached 93.86 ± 0.95%. Thiamethoxam degradation followed a second-order reaction kinetics equation, and the rate constant decreased with increasing the initial thiamethoxam concentration. Free-radical quenching experiments indicated that both O2 and ∙OH were present within the 3DE-GAC-O3 system, with ∙OH being the predominant species. A GC-MS analysis revealed the formation of several intermediate products, which were characterized based on the mass fragmentation pattern. Additionally, a probable degradation pathway for thiamethoxam was proposed. Therefore, 3DE-GAC-O3 is an efficient method for the pretreatment of thiamethoxam wastewater. Full article
(This article belongs to the Special Issue Advanced Catalytic Processes for Wastewater Treatment)
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31 pages, 21025 KiB  
Article
Optimization of Ultrasonic Extraction Parameters for the Recovery of Phenolic Compounds in Brown Seaweed: Comparison with Conventional Techniques
by Zu Jia Lee, Cundong Xie, Xinyu Duan, Ken Ng and Hafiz A. R. Suleria
Antioxidants 2024, 13(4), 409; https://doi.org/10.3390/antiox13040409 - 28 Mar 2024
Cited by 13 | Viewed by 3711
Abstract
Seaweed, in particular, brown seaweed, has gained research interest in the past few years due to its distinctive phenolic profile that has a multitude of bioactive properties. In order to obtain the maximum extraction efficiency of brown seaweed phenolic compounds, Response Surface Methodology [...] Read more.
Seaweed, in particular, brown seaweed, has gained research interest in the past few years due to its distinctive phenolic profile that has a multitude of bioactive properties. In order to obtain the maximum extraction efficiency of brown seaweed phenolic compounds, Response Surface Methodology was utilized to optimize the ultrasound-assisted extraction (UAE) conditions such as the amplitude, time, solvent:solid ratio, and NaOH concentration. Under optimal conditions, UAE had a higher extraction efficiency of free and bound phenolic compounds compared to conventional extraction (stirred 16 h at 4 °C). This led to higher antioxidant activity in the seaweed extract obtained under UAE conditions. The profiling of phenolic compounds using LC-ESI-QTOF-MS/MS identified a total of 25 phenolics with more phenolics extracted from the free phenolic extraction compared to the bound phenolic extracts. Among them, peonidin 3-O-diglucodise-5-O-glucoside and hesperidin 5,7-O-diglucuronide are unique compounds that were identified in P. comosa, E. radiata and D. potatorum, which are not reported in plants. Overall, our findings provided optimal phenolic extraction from brown seaweed for research into employing brown seaweed as a functional food. Full article
(This article belongs to the Special Issue New Insights into Phytochemical Antioxidants in Food—2nd Edition)
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14 pages, 2027 KiB  
Article
The Relationship between Bone Health Parameters, Vitamin D and Iron Status, and Dietary Calcium Intake in Young Males
by Jadwiga Malczewska-Lenczowska, Olga Surała, Dominika Granda, Beata Szczepańska, Adam Czaplicki and Rafał Kubacki
Nutrients 2024, 16(2), 215; https://doi.org/10.3390/nu16020215 - 9 Jan 2024
Cited by 6 | Viewed by 3500
Abstract
Vitamin D, calcium, and iron are micronutrients crucial for bone health. However, their effect has been studied primarily in the cortical bone, with vitamin D status being assessed mainly from the total 25(OH)D serum fraction. The study aimed to investigate the impact of [...] Read more.
Vitamin D, calcium, and iron are micronutrients crucial for bone health. However, their effect has been studied primarily in the cortical bone, with vitamin D status being assessed mainly from the total 25(OH)D serum fraction. The study aimed to investigate the impact of vitamin D (total and free fraction) and iron status (i.e., serum ferritin or soluble transferrin receptor) and calcium intake (ADOS-Ca questionnaire) on lumbar cortical and trabecular bone. In a cohort of 113 male subjects (76 athletes, 37 non-athletes) aged 15–19, the lumbar spine status (Z-score, bone mineral apparent density (BMAD), and trabecular bone score (TBS)) was determined using dual-energy X-ray absorptiometry (DXA). Relationships between the examined micronutrients and bone health parameters were observed only in athletes. Free 25(OH)D was significantly (p < 0.001) correlated with Z-score and BMAD, while total 25(OH)D (p < 0.001) and iron status (ferritin, Fe stores; p < 0.01) correlated solely with BMAD. Free 25(OH)D and ferritin concentrations were the best determinants of bone status (R2 = 0.330; p < 0.001) and explained 25% and 7% of the BMAD variance, respectively. No relationships were found between the micronutrients and TBS. The results confirmed the positive influence of vitamin D and iron on cortical, but not trabecular, bone status solely in physically active subjects. In athletes, free 25(OH)D seems to be a superior indicator of bone health to a total 25(OH)D fraction. Full article
(This article belongs to the Special Issue Role of Vitamin D in Chronic Diseases)
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15 pages, 5511 KiB  
Article
Research on the Working Performance and the Corresponding Mechanical Strength of Polyaluminum Sulfate Early Strength Alkali-Free Liquid Accelerator Matrix Cement
by Lin Wang, Xinxin He, Chunxue Shu, Zicheng Wei and Hui Wang
Materials 2022, 15(22), 8086; https://doi.org/10.3390/ma15228086 - 15 Nov 2022
Cited by 8 | Viewed by 1935
Abstract
Liquid accelerating agents have the advantages of simple operation and fast construction, and have become indispensable admixtures in shotcrete. However, most liquid accelerating agents in the market at present contain alkali or fluorine, which adversely affect concrete and seriously threaten the physical and [...] Read more.
Liquid accelerating agents have the advantages of simple operation and fast construction, and have become indispensable admixtures in shotcrete. However, most liquid accelerating agents in the market at present contain alkali or fluorine, which adversely affect concrete and seriously threaten the physical and mental health of workers. Therefore, in view of the above deficiencies, it is necessary to develop a new type of alkali-free fluorine-free liquid accelerating agent. In this paper, the polyaluminum sulfate early strength alkali-free liquid accelerator is prepared using polymeric aluminum sulfate, diethanolamine, magnesium sulfate heptahydrate and nano-silica. The influence of this agent on the setting time of fresh cement paste and compressive strength of the corresponding cement mortar is determined. Thermogravimetric analysis curves, X-ray diffraction and scanning electron microscopy images are obtained to investigate the mechanism. Findings show that the initial setting time and the final setting time of cement paste are 2 min 30 s and 7 min 25 s. The compressive strengths of cement mortar cured for 1 d, 28 d and 90 d are 2.4 MPa, 52.2 MPa and 54.3 MPa respectively. Additionally, the corresponding flexural strengths are 3.4 MPa, 9.8 MPa, 11.8 MPa. When the mass rate of accelerator is 7%, the mechanical strengths of cement mortar are the highest. The additions of fly ash and blast furnace slag can affect the mechanical of cement mortar mixed with accelerator. When the mass ratio of the fly ash and blast furnace slag is 15%, the mechanical strengths of cement mortar reach the highest. Moreover, the hydration heat release rate of cement is increased by the accelerator and the corresponding time of hydration heat peak is decreased by the accelerator. The accelerator can decrease the amount of needle-like hydration products and improve the compactness. The mechanical strengths are improved by consuming a large amount of Ca(OH)2 and forming more compact hydration products. It is recommended that the optimum dosage range of the polyaluminum sulfate early strength alkali-free liquid accelerator is 7%. Full article
(This article belongs to the Special Issue Durability and Sustainability of Cement and Concrete Composites)
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12 pages, 2886 KiB  
Article
Template-Free Preparation of α-Ni(OH)2 Nanosphere as High-Performance Electrode Material for Advanced Supercapacitor
by Rongrong Zhang, Qian Tu, Xianran Li, Xinyu Sun, Xinghai Liu and Liangzhe Chen
Nanomaterials 2022, 12(13), 2216; https://doi.org/10.3390/nano12132216 - 28 Jun 2022
Cited by 15 | Viewed by 2427
Abstract
Although it is one of the promising candidates for pseudocapacitance materials, Ni(OH)2 is confronted with poor specific capacitance and inferior cycling stability. The design and construction of three-dimensional (3D) nanosphere structures turns out to be a valid strategy to combat these disadvantages [...] Read more.
Although it is one of the promising candidates for pseudocapacitance materials, Ni(OH)2 is confronted with poor specific capacitance and inferior cycling stability. The design and construction of three-dimensional (3D) nanosphere structures turns out to be a valid strategy to combat these disadvantages and has attracted tremendous attention. In this paper, a 3D α-Ni(OH)2 nanosphere is prepared via a facile and template-free dynamic refluxing approach. Significantly, the α-Ni(OH)2 nanosphere possesses a high specific surface area (119.4 m2/g) and an abundant porous structure. In addition, the as-obtained α-Ni(OH)2 electrodes are investigated by electrochemical measurements, which exhibit a high specific capacitance of 1243 F/g at 1 A/g in 6 M KOH electrolyte and an acceptable capacitive retention of 40.0% after 1500 charge/discharge cycles at 10 A/g, which can be attributed to the sphere’s unique nanostructure. Furthermore, the as-assembled Ni(OH)2-36//AC asymmetric supercapacitor (ASC) yields a remarkable energy density of 26.50 Wh/kg, with a power density of 0.82 kW/kg. Notably, two ASCs in series can light a 2.5 V red lamp sustainably for more than 60 min, as well as power an LED band with a rated power of 25 W. Hence, this 3D α-Ni(OH)2 nanosphere may raise great potential applications for next-generation energy storage devices. Full article
(This article belongs to the Section Synthesis, Interfaces and Nanostructures)
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14 pages, 2018 KiB  
Article
Distribution and Determinants of Vitamin D-Binding Protein, Total, “Non-Bioavailable”, Bioavailable, and Free 25-Hydroxyvitamin D Concentrations among Older Adults
by Anna Zhu, Sabine Kuznia, Tobias Niedermaier, Bernd Holleczek, Ben Schöttker and Hermann Brenner
Nutrients 2021, 13(11), 3982; https://doi.org/10.3390/nu13113982 - 9 Nov 2021
Cited by 11 | Viewed by 2696
Abstract
Background: serum 25-hydroxyvitamin D (25(OH)D) (“total 25 OH(D)”) is the most commonly used indicator of vitamin D status. However, 25(OH)D is mostly bound to the vitamin D binding protein (VDBP) or albumin in blood, and it has been suggested that the remaining bioavailable [...] Read more.
Background: serum 25-hydroxyvitamin D (25(OH)D) (“total 25 OH(D)”) is the most commonly used indicator of vitamin D status. However, 25(OH)D is mostly bound to the vitamin D binding protein (VDBP) or albumin in blood, and it has been suggested that the remaining bioavailable or free 25(OH)D may be more relevant for vitamin D associated health outcomes. We aimed to explore distributions and determinants of VDBP, total, bioavailable, complementary “non-bioavailable”, and free 25(OH)D in a large cohort of older adults in Germany. Methods: total 25(OH)D, VDBP, and albumin concentrations were measured in blood samples of 5899 men and women aged 50–75 years and used to calculate bioavailable (and complementary “non-bioavailable”) and free 25(OH)D concentrations. Linear regression models were used to evaluate associations of potential determinants of the various vitamin D biomarkers. Results: mean concentrations of VDBP, total, non-bioavailable, bioavailable, and free 25(OH)D were 323.6 µg/mL, 49.8 nmol/L, 43.4 nmol/L, 2.5 ng/mL, and 5.7 pg/mL, respectively. Seasonal variations were observed for all markers, with peak values in spring for VDBP and in summer for total, non-bioavailable, bioavailable, and free 25(OH)D. Consistent inverse associations were seen with age and body mass index for all markers, but divergent associations were seen with C-reactive protein. Strong variations by VDBP genotypes were seen for bioavailable and free 25(OH)D, and, in opposite direction for non-bioavailable 25(OH)D. Conclusion: commonalities and differences in determinants of various markers of vitamin D status were observed, which may help to enable a better understanding of their potential role for various vitamin D related health outcomes. Full article
(This article belongs to the Special Issue Vitamins and Human Health)
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14 pages, 1136 KiB  
Article
Evaluation of Vitamin D Metabolism in Patients with Type 1 Diabetes Mellitus in the Setting of Cholecalciferol Treatment
by Alexandra Povaliaeva, Ekaterina Pigarova, Artem Zhukov, Viktor Bogdanov, Larisa Dzeranova, Olga Mel’nikova, Elena Pekareva, Natalya Malysheva, Vitaliy Ioutsi, Larisa Nikankina and Liudmila Rozhinskaya
Nutrients 2020, 12(12), 3873; https://doi.org/10.3390/nu12123873 - 18 Dec 2020
Cited by 12 | Viewed by 3114
Abstract
In this prospective controlled study, we examined 25 adults with adequately controlled (HbA1c level < 8.0%) type 1 diabetes mellitus (T1DM) and 49 conditionally healthy adults, intending to reveal the diversity of vitamin D metabolism in the setting of cholecalciferol intake at a [...] Read more.
In this prospective controlled study, we examined 25 adults with adequately controlled (HbA1c level < 8.0%) type 1 diabetes mellitus (T1DM) and 49 conditionally healthy adults, intending to reveal the diversity of vitamin D metabolism in the setting of cholecalciferol intake at a therapeutic dose. All patients received a single dose (150,000 IU) of cholecalciferol aqueous solution orally. Laboratory assessments including serum vitamin D metabolites (25(OH)D3, 25(OH)D2, 1,25(OH)2D3, 3-epi-25(OH)D3 and 24,25(OH)2D3), free 25(OH)D, vitamin D-binding protein (DBP) and parathyroid hormone (PTH) as well as serum and urine biochemical parameters were performed before the intake and on Days 1, 3 and 7 after the administration. The studied groups had no significant differences in baseline parameters except that the patients with diabetes showed higher baseline levels of free 25(OH)D (p < 0.05). They also lacked a correlation between the measured and calculated free 25(OH)D in contrast to the patients from the control group (r = 0.41, p > 0.05 vs. r = 0.88, p < 0.05), possibly due to the glycosylation of binding proteins, which affects the affinity constant for 25(OH)D. The elevation of vitamin D levels after the administration of cholecalciferol was comparable in both groups, with slightly higher 25(OH)D3 levels observed in the diabetes group throughout the study since Day 1 (p < 0.05). Overall, our data indicate that in patients with adequately controlled T1DM 25(OH)D3 levels and the therapeutic response to cholecalciferol is similar to that in healthy individuals. Full article
(This article belongs to the Special Issue Vitamin D, Diet and Musculoskeletal Health)
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17 pages, 2300 KiB  
Article
Dissolution, Stability and Solubility of Tooeleite [Fe6(AsO3)4(SO4)(OH)4·4H2O] at 25–45 °C and pH 2–12
by Zongqiang Zhu, Jun Zhang, Yinian Zhu, Jie Liu, Shen Tang, Lihao Zhang and Yaru Wang
Minerals 2020, 10(10), 921; https://doi.org/10.3390/min10100921 - 19 Oct 2020
Cited by 7 | Viewed by 4214
Abstract
Tooeleite [Fe6(AsO3)4(SO4)(OH)4·4H2O] was synthesized and characterized to investigate its possible immobilization for arsenic in acidic and alkali environments by a long-term dissolution of 330 d. The synthetic tooeleite was platy crystallites [...] Read more.
Tooeleite [Fe6(AsO3)4(SO4)(OH)4·4H2O] was synthesized and characterized to investigate its possible immobilization for arsenic in acidic and alkali environments by a long-term dissolution of 330 d. The synthetic tooeleite was platy crystallites of ~1μm across, giving the lattice parameters of a = 6.4758 Å, b = 19.3737 Å and c = 8.9170 Å. For the tooeleite dissolution, the dissolved arsenic concentration showed the lowest value of 427.3~435.8 mg/L As at initial pH 12 (final pH 5.54). The constituents were dissolved preferentially in the sequence of SO42− > AsO33− > Fe3+ in the aqueous medium at initial pH 2–12. The dissolved iron, arsenite and sulfate existed mainly as FeSO4+/Fe3+, H3AsO30 and SO42− at initial pH 2, and in the form of Fe(OH)30/Fe(OH)2+, H3AsO30 and SO42− at initial pH 12, respectively. The tooeleite dissolution was characterized by the preferential releases of SO42− anions from solid surface into aqueous medium, which was fundamentally controlled by the Fe-O/OH bond breakages and the outer OH group layers. From the data of the dissolution at 25 °C and initial pH 2 for 270–330 d, the ion-activity product [logˍIAP], which equaled the solubility product [Ksp] at the dissolution equilibrium, and the Gibbs free energy of formation [ΔGfo] were estimated as −200.28 ± 0.01 and −5180.54 ± 0.07 kJ/mol for the synthetic tooeleite, respectively. Full article
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16 pages, 2172 KiB  
Article
Novel Insights into the Thioesterolytic Activity of N-Substituted Pyridinium-4-oximes
by Blaženka Foretić, Vladimir Damjanović, Robert Vianello and Igor Picek
Molecules 2020, 25(10), 2385; https://doi.org/10.3390/molecules25102385 - 21 May 2020
Cited by 4 | Viewed by 2962
Abstract
The pyridinium oximes are known esterolytic agents, usually classified in the literature as catalysts, which mimic the catalytic mode of hydrolases. Herein, we combined kinetic and computational studies of the pyridinium-4-oxime-mediated acetylthiocholine (AcSCh+) hydrolysis to provide novel insights into their potential [...] Read more.
The pyridinium oximes are known esterolytic agents, usually classified in the literature as catalysts, which mimic the catalytic mode of hydrolases. Herein, we combined kinetic and computational studies of the pyridinium-4-oxime-mediated acetylthiocholine (AcSCh+) hydrolysis to provide novel insights into their potential catalytic activity. The N-methyl- and N-benzylpyridinium-4-oximes have been tested as oximolytic agents toward the AcSCh+, while the newly synthesized O-acetyl-N-methylpyridinium-4-oxime iodide was employed for studying the consecutive hydrolytic reaction. The relevance of the AcSCh+ hydrolysis as a competitive reaction to AcSCh+ oximolysis was also investigated. The reactions were independently studied spectrophotometrically and rate constants, koxime, kw and kOH, were evaluated over a convenient pH-range at I = 0.1 M and 25 °C. The catalytic action of pyridinium-4-oximes comprises two successive stages, acetylation (oximolysis) and deacetylation stage (pyridinium-4-oxime-ester hydrolysis), the latter being crucial for understanding the whole catalytic cycle. The complete mechanism is presented by the free energy reaction profiles obtained with (CPCM)/M06–2X/6–311++G(2df,2pd)//(CPCM)/M06–2X/6–31+G(d) computational model. The comparison of the observed rates of AcSCh+ oximolytic cleavage and both competitive AcSCh+ and consecutive pyridinium-4-oxime-ester hydrolytic cleavage revealed that the pyridinium-4-oximes cannot be classified as non-enzyme catalyst of the AcSCh+ hydrolysis but as the very effective esterolytic agents. Full article
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19 pages, 9433 KiB  
Article
3D Printing Cellulose Hydrogels Using LASER Induced Thermal Gelation
by Tim Huber, Don Clucas, Mathieu Vilmay, Birte Pupkes, James Stuart, Simone Dimartino and Conan Fee
J. Manuf. Mater. Process. 2018, 2(3), 42; https://doi.org/10.3390/jmmp2030042 - 2 Jul 2018
Cited by 15 | Viewed by 5742
Abstract
A 3D printer was developed for the 3D printing of cellulose hydrogels using open source software and simple 3D printer hardware. Using a temperature-based sol-gel transition of cellulose dissolved in aqueous solutions of sodium hydroxide (NaOH) and urea, a three-dimensional gel can be [...] Read more.
A 3D printer was developed for the 3D printing of cellulose hydrogels using open source software and simple 3D printer hardware. Using a temperature-based sol-gel transition of cellulose dissolved in aqueous solutions of sodium hydroxide (NaOH) and urea, a three-dimensional gel can be created by moving a focused laser beam across a bath of the cellulose solution and lowering the print stage after every layer. A line width of 100–150 µm and layer thickness of 25 µm of the printed part could be achieved. No delamination between printed layers occurred and no additional support material was needed to create free hanging structures due to suspending the printed part in printing liquid. By adding cellulose powder to the solution, the gelation temperature, the gel strength and stiffness can be manipulated while maintaining a high internal porosity of the gel. A laser power of 100 mW was found to produce the highest quality print with an accurate representation of the previously designed part. Lower power settings (80 mW) produced insufficient gelation and as a result reduced print accuracy while higher power settings (120 mW) caused the gel to burn. Full article
(This article belongs to the Special Issue Additive Manufacturing)
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8 pages, 226 KiB  
Article
The Association of Vitamin D Status with Dyslipidaemia and Biomarkers of Endothelial Cell Activation in Older Australians
by Ali M. Alyami, Virginie Lam, Mario J. Soares, Yun Zhao, Jillian L. Sherriff, John C. Mamo, Anthony P. James and Fiona Coombes
Nutrients 2016, 8(8), 457; https://doi.org/10.3390/nu8080457 - 28 Jul 2016
Cited by 9 | Viewed by 5438
Abstract
Background/Aims: Vitamin D has been investigated for many non-skeletal effects. The objective of this study was to determine whether circulating lipids, systemic inflammation, and biomarkers of endothelial cell activation varied with the vitamin D status of older Australians. Methods: One hundred and one [...] Read more.
Background/Aims: Vitamin D has been investigated for many non-skeletal effects. The objective of this study was to determine whether circulating lipids, systemic inflammation, and biomarkers of endothelial cell activation varied with the vitamin D status of older Australians. Methods: One hundred and one participants were proportionately and randomly sampled across tertiles of 25 hydroxy vitamin D (25(OH)D) from a larger cohort of free living older adults (T1 median = 97; T2 median = 74.5; T3 median = 56.8 nmol/L). Overnight fasting blood samples were assayed for 25(OH)D, parathyroid hormone (PTH), insulin, triacylglycerol (TAG), total cholesterol (TC), low density lipoprotein cholesterol (LDL-C) and high density lipoprotein cholesterol (HDL-C). Markers of systemic inflammation (high sensitivity C-reactive protein (hsCRP), tumour necrosis factor-α (TNF-α)) and endothelial activation (hepatocyte growth factor (HGF), P-selectin and soluble vascular cell adhesion molecule (sVCAM), soluble intracellular adhesion molecule (sICAM)) were determined. A general linear model multivariate analysis with a backward elimination procedure was performed. Results: Eighty-three participants (48 women, 35 men), aged 65 ± 7.7 years, BMI 28 ± 4.5 kg/m2, with complete data were analyzed. The final parsimonious model controlled for age, gender, BMI, and McAuley’s index, but excluded season, medications, and PTH. There were significant differences across 25(OH)D tertiles in TC (T1 < T3, p = 0.003; T2 < T3, p = 0.001), LDL-C (T1 < T3, p = 0.005; T2 < T3, p = 0.001), TAG (T2 < T3, p = 0.026), HGF (T1 > T3, p = 0.009) and sVCAM (T1 > T3, P = 0.04). Conclusions: Higher vitamin D status may protect the endothelium through reduced dyslipidaemia and increased HGF. Full article
(This article belongs to the Special Issue Vitamin D: Current Issues and New Perspectives)
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