bluuebunny/crossref_metadata_2025 huggingface dataset:
Polypyrrole Decorated Flower-like and Rod-like ZnO Composites with Improved Microwave Absorption Performance
Authors: Zhang Leilei , Lv Yihua , Ye Xiaoyun , Ma Lian , Chen Song , Wu Yuping , Wang Qianting
Published: May 2022

In this study, zinc oxide (ZnO)/polypyrrole (PPy) composites with flower- and rod-like structures were successfully fabricated by in situ polymerization and the hydrothermal method and used as microwave absorption (MWA) materials. The surface morphologies, crystal structures, and electromagnetic features of the as-prepared samples were measured by field-emission scanning electron microscopy (FE-SEM), energy dispersive spectroscopy (EDS), X-ray diffraction (XRD), and vector network analyzer (VNA). The results show that the conductive polymer PPy was successfully decorated on the surface of ZnO substrates. The MWA ability of flower- and rod-like ZnO/PPy composites is significantly enhanced after introduction of PPy. Rod-like ZnO/PPy composites exhibited superior MWA properties than those of flower-like ZnO/PPy. The former achieved a minimum reflection loss (RLmin) of −59.7 dB at 15.8 GHz with a thickness of 2.7 mm, and the effective absorption bandwidth (EAB, RL < −10 dB) covered 6.4 GHz. PPy addition and stacked structure of rod-like ZnO/PPy composites can effectively improve the dielectric properties, form multiple reflections of incident electromagnetic waves, and generate an interfacial polarization effect, resulting in improved MWA properties of composite materials.
Effect of Stress on Irradiation Responses of Highly Oriented Pyrolytic Graphite
Authors: Hu Zhihan , Chen Di , Kim SeungSu , Chauhan Rijul , Li Yongchang , Shao Lin
Published: May 2022

The effect of stress on irradiation responses of highly oriented pyrolytic graphite (HOPG) was studied by combing molecular dynamics (MD) simulation, proton irradiation, and Raman characterization. MD simulations of carbon knock-on at energies < 60 eV were used to obtain average threshold displacement energies (E¯d) as a function of strain ranging from 0 to 10%. Simulations at a higher irradiation energy of 2–5 keV were used to study the effect of strain on damage cascade evolution. With increasing tensile strain, E¯d was reduced from 35 eV at 0% strain to 31 eV at 10% strain. The strain-reduced E¯d led to a higher damage peak and more surviving defects (up to 1 ps). Furthermore, high strains induced local cleavage around the cavities, as one additional mechanism of damage enhancement. Experimentally, HOPG film was folded, and the folded region with the maximum tensile stress was irradiated by a 2 MeV proton beam. Raman characterization showed significantly enhanced D to G modes in comparison to the stress-free irradiation. Based on the strain dependence of E¯d and the Kinchin–Pease model, a formula for displacement estimation under different tensile strains is proposed. The stress effects need to be considered in graphite applications in a reactor’s harsh environment where both neutron damage and stress are present.
Development and Optimization of Broadband Acoustic Metamaterial Absorber Based on Parallel–Connection Square Helmholtz Resonators
Authors: Wang Enshuai , Yang Fei , Shen Xinmin , Duan Haiqin , Zhang Xiaonan , Yin Qin , Peng Wenqiang , Yang Xiaocui , Yang Liu
Published: May 2022

An acoustic metamaterial absorber of parallel–connection square Helmholtz resonators is proposed in this study, and its sound absorption coefficients are optimized to reduce the noise for the given conditions in the factory. A two–dimensional equivalent simulation model is built to obtain the initial value of parameters and a three–dimensional finite element model is constructed to simulate the sound absorption performance of the metamaterial cell, which aims to improve the research efficiency. The optimal parameters of metamaterial cells are obtained through the particle swarm optimization algorithm, and its effectiveness and accuracy are validated through preparing the experimental sample using 3D printing and measuring the sound absorption coefficient by the standing wave tube detection. The consistency between the experimental data and simulation data verifies feasibility of the proposed optimization method and usefulness of the developed acoustic metamaterial absorber, and the desired sound absorption performances for given conditions are achieved. The experimental results prove that parallel–connection square Helmholtz resonators can achieve an adjustable frequency spectrum for the low frequency noise control by parameter optimization, which is propitious to promote its application in reducing the noise in the factory.
Corrosion of Alumina-Spinel Refractory by Secondary Metallurgical Slag Using Coating Corrosion Test
Authors: Darban Sina , Reynaert Camille , Ludwig Maciej , Prorok Ryszard , Jastrzębska Ilona , Szczerba Jacek
Published: May 2022

In this paper, the corrosion mechanism of commercial alumina-spinel refractory was investigated at 1350 and 1450 °C. Disc samples were coated with shells of two different slags containing 4 and 10 wt.% SiO2. The after-corrosion refractory was investigated in view of changes in its microstructure and phase composition by SEM/EDS and XRD techniques, respectively. At 1350 °C slags slightly infiltrated the microstructure, whereas at 1450 °C slags infiltrated the alumina-spinel refractory causing its significant corrosion. As a result of corrosion, new phases were formed, including calcium dialuminate (Ca2Al4O7), calcium hexaluminate (CaAl12O19), and gehlenite (Ca2AlSi2O7). Formation of calcium aluminate layers in the microstructure of the refractory inhibited further dissolution of alumina aggregates; however, expansive behavior of CaAl12O19 raised the microstructure porosity. The additional SiO2 in the slag doubled the amount of low melting gehlenite in the matrix, accelerating the corrosion process of alumina-spinel brick at high temperatures.
A Highly Stable and Sustainable Low-Temperature Selective Absorber: Structural and Ageing Characterisation
Authors: Farchado Meryem , San Vicente Gema , Germán Nuria , Maffiotte César , Morales Ángel
Published: May 2022

Solar absorbers in a three-layer configuration have been prepared by dip-coating onto aluminium substrates. They are constituted by two spinel layers with one silica layer on the top and values of solar absorptance above 0.950 and thermal emittance below 0.04 were obtained. The effects of using different sintering conditions of the upper silica layer on the optical behaviour and durability tests have been studied. Results obtained in accelerated ageing methods, such as thermal stability tests and condensation tests, clearly show that the proposed selective absorber exhibits excellent thermal stability and very good humidity resistance. The results show that the protective action is due not only to the silica layer but also to the alumina layer produced during the absorber preparation. The phase composition of the individual layers was independently confirmed using X-ray diffraction and corroborated by X-ray Photoelectron Spectroscopy. Spinel-like phases were obtained in both the first and second layers. The ageing study shows that the three-layer configuration proposed has a very high potential, in terms of both durability and optical behaviour, for solar thermal low-temperature applications.
Recent Advances in Wearable Potentiometric pH Sensors
Authors: Tang Yitian , Zhong Lijie , Wang Wei , He Ying , Han Tingting , Xu Longbin , Mo Xiaocheng , Liu Zhenbang , Ma Yingming , Bao Yu , Gan Shiyu , Niu Li
Published: May 2022

Wearable sensors reflect the real–time physiological information and health status of individuals by continuously monitoring biochemical markers in biological fluids, including sweat, tears and saliva, and are a key technology to realize portable personalized medicine. Flexible electrochemical pH sensors can play a significant role in health since the pH level affects most biochemical reactions in the human body. pH indicators can be used for the diagnosis and treatment of diseases as well as the monitoring of biological processes. The performances and applications of wearable pH sensors depend significantly on the properties of the pH–sensitive materials used. At present, existing pH–sensitive materials are mainly based on polyaniline (PANI), hydrogen ionophores (HIs) and metal oxides (MOx). In this review, we will discuss the recent progress in wearable pH sensors based on these sensitive materials. Finally, a viewpoint for state–of–the–art wearable pH sensors and a discussion of their existing challenges are presented.
A Novel BiOCl Based Nanocomposite Membrane for Water Desalination
Authors: Akbarzadeh Rokhsareh , Ndungu Patrick Gathura
Published: May 2022

In this study, BiOCl based nanocomposites were used as photocatalytic membranes for a simulated study on water desalination in reverse osmosis membrane systems. Through molecular dynamic simulation, the molecular structure of BiOCl, BiOCl/Ag2S and BiOCl/Bi2O3 heterojunctions were designed and their electronic properties, mechanical properties, and membrane performance for water desalination were evaluated for the first time. The molecular structure was created, and a geometry optimization task was used to optimize it. Material Studio 2019 CASTEP was used for simulation of the electronic and mechanical properties and water desalination was performed by ReaxFF software under pressures between 0 and 250 MPa. The novel BiOCl based nanocomposites showed improved electronic and mechanical properties and, most importantly, improvements in salt rejection and water permeability as compared to well-known materials such as graphene and MoS2. BiOCl and BiOCl/Ag2S had a bandgap around two, which is the ideal bandgap for semiconductor photocatalysts. A salt rejection of 98% was achieved under an applied pressure of 10 MPa. Salt rejection was higher for BiOCl/Bi2O3, while water permeability was higher for BiOCl/Ag2S. The monolayer BiOCl was unstable under pressures higher than 50 MPa, but the mechanical stability of BiOCl/Ag2S increased twofold and increased fourfold for BiOCl/Bi2O3, which is even higher than MoS2. However, between the three nanocomposites, BiOCl/Ag2S was found to be the most ideal photocatalytic nanocomposite membrane.
A Sensitive LC-MS/MS Method for the Simultaneous Determination of Two Thia-Analogous Indirubin N-Glycosides and Indirubin-3′-Monoxime in Plasma and Cell Culture Medium
Authors: Fischle Alica , Schwarz Rico , Wendt Franziska , Kordt Marcel , Ramer Robert , Boeckmann Lars , Hein Martin , Langer Peter , Emmert Steffen , Vollmar Brigitte , Hinz Burkhard
Published: May 2022

Indirubin was identified as an active component of Danggui Longhui Wan, an herbal mixture used in traditional Chinese medicine, and showed anticancer activity in clinical trials in patients with chronic leukemia. Investigations on the mechanisms of antitumor action of indirubins have mainly focused on the indirubin derivative indirubin-3′-monoxime (I3M). Meanwhile, antiproliferative and cytotoxic properties on cancer cells have also been demonstrated for several synthetic indirubin N-glycosides. In the present study, we demonstrate cytotoxic activity of the thia-analogous indirubin N-glycosides KD87 (3-[3′-oxo-benzo[b]thiophen-2′-(Z)-ylidene]-1-(β-d-glucopyranosyl)-oxindole) and KD85 (3-[3′-oxo-benzo[b]thiophen-2′-(Z)-ylidene]-1-(β-d-mannopyranosyl)-oxindole) against melanoma and squamous cell carcinoma cells as well as lung cancer and glioblastoma cells. The advanced state of preclinical studies on the effects of indirubins conducted to date underscores the need for pharmacokinetic data from cellular, animal, and human studies for which reliable quantification is required. Therefore, a sensitive liquid chromatography-tandem mass spectrometric (LC-MS/MS) method was developed and validated for the simultaneous measurement of KD87, KD85, and I3M in plasma and cell culture medium. Experimental conditions for sample preparation were optimized for human plasma protein precipitation and liquid-liquid extraction from plasma and cell culture medium. The methods were successfully validated in accordance with the U.S. Food and Drug Administration Bioanalytical Method Validation and evaluated for selectivity, sensitivity, matrix effect, recovery, carryover, calibration curve linearity, accuracy, precision, and stability. The applicability of the methods was demonstrated by the determination of KD87 in mouse plasma after prior intraperitoneal administration to mice.
A Review on Mechanistic Insight of Plant Derived Anticancer Bioactive Phytocompounds and Their Structure Activity Relationship
Authors: Mazumder Kishor , Aktar Asma , Roy Priyanka , Biswas Biswajit , Hossain Md. Emran , Sarkar Kishore Kumar , Bachar Sitesh Chandra , Ahmed Firoj , Monjur-Al-Hossain A. S. M. , Fukase Koichi
Published: May 2022

Cancer is a disorder that rigorously affects the human population worldwide. There is a steady demand for new remedies to both treat and prevent this life-threatening sickness due to toxicities, drug resistance and therapeutic failures in current conventional therapies. Researchers around the world are drawing their attention towards compounds of natural origin. For decades, human beings have been using the flora of the world as a source of cancer chemotherapeutic agents. Currently, clinically approved anticancer compounds are vincristine, vinblastine, taxanes, and podophyllotoxin, all of which come from natural sources. With the triumph of these compounds that have been developed into staple drug products for most cancer therapies, new technologies are now appearing to search for novel biomolecules with anticancer activities. Ellipticine, camptothecin, combretastatin, curcumin, homoharringtonine and others are plant derived bioactive phytocompounds with potential anticancer properties. Researchers have improved the field further through the use of advanced analytical chemistry and computational tools of analysis. The investigation of new strategies for administration such as nanotechnology may enable the development of the phytocompounds as drug products. These technologies have enhanced the anticancer potential of plant-derived drugs with the aim of site-directed drug delivery, enhanced bioavailability, and reduced toxicity. This review discusses mechanistic insights into anticancer compounds of natural origins and their structural activity relationships that make them targets for anticancer treatments.
Rediscovering the Therapeutic Potential of Agarwood in the Management of Chronic Inflammatory Diseases
Authors: Alamil Juman Mohammed Rasmi , Paudel Keshav Raj , Chan Yinghan , Xenaki Dikaia , Panneerselvam Jithendra , Singh Sachin Kumar , Gulati Monica , Jha Niraj Kumar , Kumar Deepak , Prasher Parteek , Gupta Gaurav , Malik Raniya , Oliver Brian George , Hansbro Philip Michael , Dua Kamal , Chellappan Dinesh Kumar
Published: May 2022

The inflammatory response is a central aspect of the human immune system that acts as a defense mechanism to protect the body against infections and injuries. A dysregulated inflammatory response is a major health concern, as it can disrupt homeostasis and lead to a plethora of chronic inflammatory conditions. These chronic inflammatory diseases are one of the major causes of morbidity and mortality worldwide and the need for them to be managed in the long term has become a crucial task to alleviate symptoms and improve patients’ overall quality of life. Although various synthetic anti-inflammatory agents have been developed to date, these medications are associated with several adverse effects that have led to poor therapeutic outcomes. The hunt for novel alternatives to modulate underlying chronic inflammatory processes has unveiled nature to be a plentiful source. One such example is agarwood, which is a valuable resinous wood from the trees of Aquilaria spp. Agarwood has been widely utilized for medicinal purposes since ancient times due to its ability to relieve pain, asthmatic symptoms, and arrest vomiting. In terms of inflammation, the major constituent of agarwood, agarwood oil, has been shown to possess multiple bioactive compounds that can regulate molecular mechanisms of chronic inflammation, thereby producing a multitude of pharmacological functions for treating various inflammatory disorders. As such, agarwood oil presents great potential to be developed as a novel anti-inflammatory therapeutic to overcome the drawbacks of existing therapies and improve treatment outcomes. In this review, we have summarized the current literature on agarwood and its bioactive components and have highlighted the potential roles of agarwood oil in treating various chronic inflammatory diseases.
Solubility and Permeability Enhancement of Oleanolic Acid by Solid Dispersion in Poloxamers and γ-CD
Authors: De Stefani Chiara , Lodovichi Jessika , Albonetti Laura , Salvatici Maria Cristina , Quintela José Carlos , Bilia Anna Rita , Bergonzi Maria Camilla
Published: May 2022

Oleanolic acid (OA) is a pentacyclic triterpenoid widely found in the Oleaceae family, and it represents 3.5% of the dry weight of olive leaves. OA has many pharmacological activities, such as hepatoprotection, anti-inflammatory, anti-oxidant, anti-diabetic, anti-tumor, and anti-microbic activities. Its therapeutic application is limited by its poor water solubility, bioavailability, and permeability. In this study, solid dispersions (SDs) were developed to overcome these OA limitations. Solubility studies were conducted to evaluate different hydrophilic polymers, drug-to-polymer ratios, and preparation methods. Poloxamer 188, Poloxamer 407, and γ-CD exhibited the highest increases in terms of OA solubility, regardless of the method of preparation. Binary systems were characterized using differential scanning calorimetry (DSC), X-ray diffraction (XRPD), and Fourier transform infrared spectroscopy (FTIR). In addition, pure compounds and SDs were analyzed using scanning electron microscopy (SEM) in order to observe both the morphology and the particle surface. In vitro dissolution studies were performed for P407, P188, and γ-CD SDs. Preparation using the solvent evaporation method (SEM) produced the highest increase in the dissolution profiles of all three polymers with respect to the OA solution. Finally, the effect of SDs on OA permeability was evaluated with an in vitro parallel artificial membrane permeability assay (PAMPA). The formulation improved passive permeation across the simulated barrier due to OA increased solubility. The dissolution and PAMPA results indicate that the amorphization of OA by SD preparation could be a useful method to enhance its oral absorption, and it is also applicable on an industrial scale.
Molecular Transport within Polymer Brushes: A FRET View at Aqueous Interfaces
Authors: Besford Quinn A. , Schubotz Simon , Chae Soosang , Özdabak Sert Ayşe B. , Weiss Alessia C. G. , Auernhammer Günter K. , Uhlmann Petra , Farinha José Paulo S. , Fery Andreas
Published: May 2022

Molecular permeability through polymer brush chains is implicated in surface lubrication, wettability, and solute capture and release. Probing molecular transport through polymer brushes can reveal information on the polymer nanostructure, with a permeability that is dependent on chain conformation and grafting density. Herein, we introduce a brush system to study the molecular transport of fluorophores from an aqueous droplet into the external “dry” polymer brush with the vapour phase above. The brushes consist of a random copolymer of N-isopropylacrylamide and a Förster resonance energy transfer (FRET) donor-labelled monomer, forming ultrathin brush architectures of about 35 nm in solvated height. Aqueous droplets containing a separate FRET acceptor are placed onto the surfaces, with FRET monitored spatially around the 3-phase contact line. FRET is used to monitor the transport from the droplet to the outside brush, and the changing internal distributions with time as the droplets prepare to recede. This reveals information on the dynamics and distances involved in the molecular transport of the FRET acceptor towards and away from the droplet contact line, which are strongly dependent on the relative humidity of the system. We anticipate our system to be extremely useful for studying lubrication dynamics and surface droplet wettability processes.
Arene Ru(II) Complexes Acted as Potential KRAS G-Quadruplex DNA Stabilizer Induced DNA Damage Mediated Apoptosis to Inhibit Breast Cancer Progress
Authors: Qian Jiayi , Liu Ruotong , Liu Ningzhi , Yuan Chanling , Wu Qiong , Chen Yanhua , Tan Weijun , Mei Wenjie
Published: May 2022

A series of arene Ru(II) complexes, [(η6-MeC6H5)Ru(L)Cl]Cl, (L=o-ClPIP, 1; m-ClPIP, 2 and p-ClPIP, 3) (o-ClPIP=2-(2-chlorophenyl)imidazo[4,5-f][1,10]phenanthroline; m-ClPIP=2-(3-chlorophenyl)imidazo[4,5-f][1,10]phenanthroline; p-ClPIP=2-(4-chlorophenyl)imidazo[4,5-f][1,10]phenanthroline) was synthesized and investigated as a potential apoptosis inducer in chemotherapy. Spectroscopy and molecular docking simulations show that 1 exhibits moderated binding affinity to KRAS G-quadruplex DNA by groove mode. Further, in vitro studies reveal that 1 displays inhibitory activity against MCF-7 growth with IC50 = 3.7 ± 0.2 μM. Flow cytometric analysis, comet assay, and immunofluorescence confirm that 1 can induce the apoptosis of MCF-7 cells and G0/G1 phase arrest through DNA damage. In summary, the prepared arene Ru(II) complexes can be developed as a promising candidate for targeting G-quadruplex structure to induce the apoptosis of breast cancer cells via binding and stabilizing KRAS G-quadruplex conformation on oncogene promoter.
A Chromate-Free and Convenient Route to Fabricate Thin and Compact Conversion Coating for Corrosion Protection on LZ91 Magnesium Alloy
Authors: Chen Chun-Wei , Aktug Salim Levent , Chang Chin-Jou , Lee Yueh-Lien , Ger Ming-Der , Jian Shun-Yi
Published: May 2022

This study characterizes and determines the corrosion resistance of Mn-Ce conversion coated LZ91 magnesium alloy that undergoes pretreatments. It is challenging to process large and curved workpieces in the industry because the geometric shapes are complex if they are mechanically ground. This study uses acid pickling instead of mechanical grinding, and a nitric acid solution is used for pickling. After pretreatments, the samples are immersed for 30 s in a conversion coating solution containing 0.1 M KMnO4 and 0.025 M Ce(NO3)3 with a pH of 1.5, as demonstrated in previous studies by the authors. The microstructure of the coating layer and electrochemical behavior of conversion coated samples exposed to 3.5 wt.% NaCl solution are studied. The corrosion behavior of Mn-Ce conversion coating specimens is determined using a salt spray test (SST). Scanning electron microscopy (SEM), energy dispersive X-ray spectrometry (EDS), and X-ray photoelectron spectroscopy (XPS) are used to analyze the interface between the coating layer and the underlying magnesium substrate and to investigate the microstructure of the specimens. The roughness of the coatings is measured using 3D white light interferometry. The results show that the deteriorated area ratio for conversion coated LZ91 decreases to less than 5% after 72 h of SST exposure, and the corrosion resistance is improved 2.25 times with the Mn-Ce conversion coating on LZ91 magnesium alloy.
Changes in Serum Levels of Ketone Bodies and Human Chorionic Gonadotropin during Pregnancy in Relation to the Neonatal Body Shape: A Retrospective Analysis
Authors: Noshiro Kiwamu , Umazume Takeshi , Hattori Rifumi , Kataoka Soromon , Yamada Takashi , Watari Hidemichi
Published: May 2022

Among the physiological changes occurring during pregnancy, the benefits of morning sickness, which is likely mediated by human chorionic gonadotropin (HCG) and induces serum ketone production, are unclear. We investigated the relationship between serum levels of ketone bodies and HCG in the first, second, and third trimesters and neonatal body shape (i.e., birth weight, length, head circumference, and chest circumference) in 245 pregnant women. Serum levels of 3-hydroxybutyric acid peaked in late-stage compared with early stage pregnancy (27.8 [5.0–821] vs. 42.2 [5.0–1420] μmol/L, median [range], p < 0.001). However, serum levels of ketone bodies and HCG did not correlate with neonatal body shape. When weight loss during pregnancy was used as an index of morning sickness, a higher pre-pregnancy body mass index was associated with greater weight loss. This study is the first to show that serum ketone body levels are maximal in the third trimester of pregnancy. As the elevation of serum ketone bodies in the third trimester is a physiological change, high serum levels of ketone bodies may be beneficial for mothers and children. One of the possible biological benefits of morning sickness is the prevention of diseases that have an increased incidence due to weight gain during pregnancy.
Acute-phase Serum Cytokine Levels and Correlation with Clinical Outcomes in Children and Adults with Primary and Secondary Dengue Virus Infection in Myanmar between 2017 and 2019
Authors: Nwe Khine Mya , Ngwe Tun Mya Myat , Myat Theingi Win , Sheng Ng Chris Fook , Htun Moh Moh , Lin Htin , Hom Nang Sarm , Soe Aung Min , Elong Ngono Annie , Hamano Shinjiro , Morita Kouichi , Thant Kyaw Zin , Shresta Sujan , Thu Hlaing Myat , Moi Meng Ling
Published: May 2022

The dengue virus (DENV) has been endemic in Myanmar since 1970, causing outbreaks every 2–3 years. DENV infection symptoms range from mild fever to lethal hemorrhage. Clinical biomarkers must be identified to facilitate patient risk stratification in the early stages of infection. We analyzed 45 cytokines and other factors in serum samples from the acute phase of DENV infection (within 3–5 days of symptom onset) from 167 patients in Yangon, Myanmar, between 2017 and 2019. All of the patients tested positive for serum DENV nonstructural protein 1 antigen (NS1 Ag); 78.4% and 62.9% were positive for immunoglobulin M (IgM) and G (IgG), respectively; and 18.0%, 19.8%, and 11.9% tested positive for serotypes 1, 3, and 4, respectively. Although the DENV-4 viral load was significantly higher than those of DENV-1 or DENV-3, disease severity was not associated with viral load or serotype. Significant correlations were identified between disease severity and CCL5, SCF, PDGF-BB, IL-10, and TNF-α levels; between NS1 Ag and SCF, CCL5, IFN-α, IL-1α, and IL-22 levels; between thrombocytopenia and IL-2, TNF-α, VEGF-D, and IL-6 levels; and between primary or secondary infection and IL-2, IL-6, IL-31, IL-12p70, and MIP-1β levels. These circulating factors may represent leading signatures in acute DENV infections, reflecting the clinical outcomes in the dengue endemic region, Myanmar.
Design, Semisynthesis, and Estrogenic Activity of Lignan Derivatives from Natural Dibenzylbutyrolactones
Authors: López-Rojas Priscila , Amesty Ángel , Guerra-Rodríguez Miguel , Brito-Casillas Yeray , Guerra Borja , Fernández-Pérez Leandro , Estévez-Braun Ana
Published: May 2022

Based on molecular docking studies on the ERα, a series of lignan derivatives (3–16) were designed and semisynthesized from the natural dibenzylbutyrolactones bursehernin (1) and matairesinol dimethyl ether (2). To examine their estrogenic and antiestrogenic potencies, the effects of these compounds on estrogen receptor element (ERE)-driven reporter gene expression and viability in human ER+ breast cancer cells were evaluated. Lignan compounds induced ERE-driven reporter gene expression with very low potency as compared with the pure agonist E2. However, coincubation of 5 μM of lignan derivatives 1, 3, 4, 7, 8, 9, 11, 13, and 14 with increasing concentrations of E2 (from 0.01 pM to 1 nM) reduced both the potency and efficacy of pure agonists. The binding to the rhERα-LBD was validated by TR-FRET competitive binding assay and lignans bound to the rhERα with IC50 values from 0.16 μM (compound 14) to 6 μM (compound 4). Induced fit docking (IFD) and molecular dynamics (MD) simulations for compound 14 were carried out to further investigate the binding mode interactions. Finally, the in silico ADME predictions indicated that the most potent lignan derivatives exhibited good drug-likeness.
Merging Experimental Design and Nanotechnology for the Development of Optimized Simvastatin Spanlastics: A Promising Combined Strategy for Augmenting the Suppression of Various Human Cancer Cells
Authors: Badr-Eldin Shaimaa M. , Aldawsari Hibah M. , Alhakamy Nabil A. , Fahmy Usama A. , Ahmed Osama A. A. , Neamatallah Thikryat , Tima Singkome , Almaghrabi Raghad H. , Alkudsi Fayda M. , Alamoudi Asmaa A. , Alzahrani Amjad A. , Kotta Sabna , Al-hejaili Omar D.
Published: May 2022

Simvastatin (SMV) is an antihyperlipidemic agent that has been investigated as a possible anti-cancer agent. An obstacle to malignant tumor therapy using drugs is the delivery of adequate levels to the cancer cells while minimizing side effects following their systemic administration. To circumvent this challenge, the researchers directed towards the field of nanotechnology to benefit from the nano-size of the formulation in passively targeting the tumor cells. Thus, our study aimed at investigating the potential of a combined mixture–process variable design for optimization of SMV spanlastics (SMV-SPNs) with minimized particle size and maximized zeta potential to enhance the anticancer activity of the drug. The study investigated the effects of Span® 20 and Tween® 80 as mixture components and sonication time as a process variable on particle size, polydispersity index, and zeta potential as responses. SPNs were prepared using an ethanol injection method. Combining the predicted optimized variables’ levels is supposed to achieve the set goals with a desirability of 0.821. The optimized spanlastics exhibited a measured globule size of 128.50 nm, PDI of 0.329, and ZP of −29.11 mV. The percentage relative error between predicted responses and the observed ones were less than 5% for the three responses, indicating the optimization technique credibility. A significant improvement in the cytotoxicity of the optimized formulation against three different cancerous cell lines was observed in comparison with SMV. The inhibitory concentration (IC50) values of MCF-7, HCT-116, and HEPG2 were found to be 0.89, 0.39, and 0.06 μM at 24 h incubation. The enhanced cytotoxicity could be assigned to the possible improved permeation and preferential build-up within the cancerous cells by virtue of the minimized size. These findings imply that SMV-SPNs could be an ideal strategy to combat cancer.
The Physics of DNA Folding: Polymer Models and Phase-Separation
Authors: Esposito Andrea , Abraham Alex , Conte Mattia , Vercellone Francesca , Prisco Antonella , Bianco Simona , Chiariello Andrea M.
Published: May 2022

Within cell nuclei, several biophysical processes occur in order to allow the correct activities of the genome such as transcription and gene regulation. To quantitatively investigate such processes, polymer physics models have been developed to unveil the molecular mechanisms underlying genome functions. Among these, phase-separation plays a key role since it controls gene activity and shapes chromatin spatial structure. In this paper, we review some recent experimental and theoretical progress in the field and show that polymer physics in synergy with numerical simulations can be helpful for several purposes, including the study of molecular condensates, gene-enhancer dynamics, and the three-dimensional reconstruction of real genomic regions.
Molecular Dynamics Study of Cellulose Nanofiber Alignment under an Electric Field
Authors: Muthoka Ruth M. , Panicker Pooja S. , Kim Jaehwan
Published: May 2022

The alignment of cellulose by an electric field is an interesting subject for cellulose material processing and its applications. This paper reports an atomistic molecular dynamics simulation of the crystalline cellulose nanofiber (CNF) model in varying electric field directions and strengths. GROMACS software was used to study crystalline cellulose 1β consisting of 18 chains in an aqueous environment at room temperature, and an electric field was applied along the cellulose chain direction and the perpendicular direction with varying field strength. The root-mean-square displacement, radius of gyration, end-to-end length, and hydrogen bond population of the crystalline CNF model were analyzed to determine the effects of the applied electric field on the structure of the CNF model. The results suggest that the nanosecond electric field can induce the orientation of the CNF along the applied electric field direction. The alignment rate and ability to maintain the alignment depend on the electric field strength. Analysis of the radius of gyration, end-to-end length, and bond lengths for intrachain and interchain hydrogen bonds revealed no significant effect on the cellulose structure. Cellulose alignment in an electric field has the potential to broaden the design of electric field-induced processing techniques for cellulose filaments, thin films, and electro-active cellulose composites.
Principled Pluralism and the Prevention of Religious Terrorism in Indonesia
Authors: Intan Benyamin Fleming , Bangun Calvin
Published: May 2022

A number of religious terrorism acts closely related to the 9/11 event had happened in Indonesia and disrupted the nation’s stability and harmony. The hard-power approach that the Indonesian government had hitherto employed to curb terrorism had not succeeded in eradicating religious terrorist groups entirely. A soft-power approach is needed to contest the indoctrination that the terrorist exercised on their followers and to halt the recruitment of new terrorists. Although the savageness of religious terrorism has given religion a terrifying impression, taking a shortcut by restricting the role of religion to the private sphere—as applied by secular countries—has not proven successful. Rejecting the solution offered by secular countries, this article offers the idea of principled pluralism with its vision of religious freedom as a soft-power solution in treating religious terrorism. By opposing tyranny and authoritarianism, religious freedom would hopefully break the chain of consolidation maintained by religious terrorists with their followers. By using principled pluralism as a hermeneutical lens to read Pancasila, this article argues that civil society is the only channel for religion to contribute significantly to Indonesian society.
Remote Sensing of Geomorphodiversity Linked to Biodiversity—Part III: Traits, Processes and Remote Sensing Characteristics
Authors: Lausch Angela , Schaepman Michael E. , Skidmore Andrew K. , Catana Eusebiu , Bannehr Lutz , Bastian Olaf , Borg Erik , Bumberger Jan , Dietrich Peter , Glässer Cornelia , Hacker Jorg M. , Höfer Rene , Jagdhuber Thomas , Jany Sven , Jung András , Karnieli Arnon , Klenke Reinhard , Kirsten Toralf , Ködel Uta , Kresse Wolfgang , Mallast Ulf , Montzka Carsten , Möller Markus , Mollenhauer Hannes , Pause Marion , Rahman Minhaz , Schrodt Franziska , Schmullius Christiane , Schütze Claudia , Selsam Peter , Syrbe Ralf-Uwe , Truckenbrodt Sina , Vohland Michael , Volk Martin , Wellmann Thilo , Zacharias Steffen , Baatz Roland
Published: May 2022

Remote sensing (RS) enables a cost-effective, extensive, continuous and standardized monitoring of traits and trait variations of geomorphology and its processes, from the local to the continental scale. To implement and better understand RS techniques and the spectral indicators derived from them in the monitoring of geomorphology, this paper presents a new perspective for the definition and recording of five characteristics of geomorphodiversity with RS, namely: geomorphic genesis diversity, geomorphic trait diversity, geomorphic structural diversity, geomorphic taxonomic diversity, and geomorphic functional diversity. In this respect, geomorphic trait diversity is the cornerstone and is essential for recording the other four characteristics using RS technologies. All five characteristics are discussed in detail in this paper and reinforced with numerous examples from various RS technologies. Methods for classifying the five characteristics of geomorphodiversity using RS, as well as the constraints of monitoring the diversity of geomorphology using RS, are discussed. RS-aided techniques that can be used for monitoring geomorphodiversity in regimes with changing land-use intensity are presented. Further, new approaches of geomorphic traits that enable the monitoring of geomorphodiversity through the valorisation of RS data from multiple missions are discussed as well as the ecosystem integrity approach. Likewise, the approach of monitoring the five characteristics of geomorphodiversity recording with RS is discussed, as are existing approaches for recording spectral geomorhic traits/ trait variation approach and indicators, along with approaches for assessing geomorphodiversity. It is shown that there is no comparable approach with which to define and record the five characteristics of geomorphodiversity using only RS data in the literature. Finally, the importance of the digitization process and the use of data science for research in the field of geomorphology in the 21st century is elucidated and discussed.
INDMF Based Regularity Calculation Method and Its Application in the Recognition of Typical Loess Landforms
Authors: Jiang Sheng , Huang Xiaoli , Jiang Ling
Published: May 2022

The topographical morphology of the loess landform on the Loess Plateau exhibits remarkable textural features at different spatial scales. However, existing topographic texture analysis studies on the Loess Plateau are usually dominated by statistical characteristics and are missing structural characteristics. At the same time, there is a lack of regularity calculation methods for DEM digital terrain analysis. Taking the Loess Plateau as the study area, a regularity calculation method based on the improved normalized distance matching function (INDMF) is proposed and applied to the classification of a loess landform. The regularity calculation method used in this study (INDMF regularity) mainly includes two key steps. Step 1 calculates the INDMF sequence value and the peak and valley values for the terrain data. Step 2 calculates the significant peak and valley, constructs the significant peak and valley sequences, and then obtains the regularity using the normalised ratio value. The experimental results show that the proposed method has good anti-interference ability and can effectively extract the regularity of the main landform unit. Compared with previous methods, adding structural features (i.e., INDMF regularity) can effectively distinguish loess hill and loess ridge in the hilly and gully region. For the loess hill and loess ridge, the recognition rates of the proposed method are 84.62% and 92.86%, respectively. Combined with the existing topographic characteristics, the proposed INDMF regularity is a topographic structure feature extraction method that can effectively discriminate between loess hill and loess ridge areas on the Loess Plateau.
Wavelength Extension of the Optimized Asymmetric-Order Vegetation Isoline Equation to Cover the Range from Visible to Near-Infrared
Authors: Miura Munenori , Obata Kenta , Yoshioka Hiroki
Published: May 2022

Vegetation isoline equations describe analytical relationships between two reflectances of different wavelengths. Their applications range from retrievals of biophysical parameters to the derivation of the inter-sensor relationships of spectral vegetation indexes. Among the three variants of vegetation isoline equations introduced thus far, the optimized asymmetric-order vegetation isoline equation is the newest and is known to be the most accurate. This accuracy assessment, however, has been performed only for the wavelength pair of red and near-infrared (NIR) bands fixed at ∼655 nm and ∼865 nm, respectively. The objective of this study is to extend this wavelength limitation. An accuracy assessment was therefore performed over a wider range of wavelengths, from 400 to 1200 nm. The optimized asymmetric-order vegetation isoline equation was confirmed to demonstrate the highest accuracy among the three isolines for all the investigated wavelength pairs. The second-best equation, the asymmetric-order isoline equation, which does not include an optimization factor, was not superior to the least-accurate equation (i.e., the first-order isoline equation) in some cases. This tendency was prominent when the reflectances of the two wavelengths were similar. By contrast, the optimized asymmetric-order vegetation isoline showed stable performance throughout this study. A single factor introduced into the optimized asymmetric-order isoline equation was concluded to effectively reduce errors in the isoline for all the wavelength combinations examined in this study.
Extracting the Secrets of OpenSSL with RAMBleed
Authors: Tomita Chihiro , Takita Makoto , Fukushima Kazuhide , Nakano Yuto , Shiraishi Yoshiaki , Morii Masakatu
Published: May 2022

Concomitant with the increasing density of semiconductors, various attacks that threaten the integrity and security of dynamic random access memory (DRAM) have been devised. Among these, a side-channel attack called RAMBleed is a prolific one that utilizes a general user-level account without special rights to read secret information. Studies have reported that it can be used to obtain OpenSSH secret keys. However, a technique for deriving the Rivest–Shamir–Adleman (RSA) secret keys used in OpenSSL under realistic parameters and environments has not been reported. We propose a method that uses RAMBleed to obtain OpenSSL secret keys and demonstrate its efficacy using the example of an Apache server. The proposed method exploits the fact that, in the operation of an Apache server that uses OpenSSL, the RSA private keys are deployed on DRAM at a set time. Although the result of reading this secret information contains a few errors, error-free secret information is obtainable when it is used with RSA cryptanalysis techniques. We performed a series of attacks incorporating RAMBleed and eventually retrieved the OpenSSL RSA private key, indicating that secret information is obtainable with high probability. The proposed method can easily and externally be executed without administrator privileges on a server using DRAM that is vulnerable to RAMBleed, showing that RAMBleed is also a major threat to OpenSSL.
Research on Fast Recognition and Localization of an Electric Vehicle Charging Port Based on a Cluster Template Matching Algorithm
Authors: Quan Pengkun , Lou Ya’nan , Lin Haoyu , Liang Zhuo , Wei Dongbo , Di Shichun
Published: May 2022

With the gradual maturity of driverless and automatic parking technologies, electric vehicle charging has been gradually developing in the direction of automation. However, the pose calculation of the charging port (CP) is an important part of realizing automatic charging, and it represents a problem that needs to be solved urgently. To address this problem, this paper proposes a set of efficient and accurate methods for determining the pose of an electric vehicle CP, which mainly includes the search and aiming phases. In the search phase, the feature circle algorithm is used to fit the ellipse information to obtain the pixel coordinates of the feature point. In the aiming phase, contour matching and logarithmic evaluation indicators are used in the cluster template matching algorithm (CTMA) proposed in this paper to obtain the matching position. Based on the image deformation rate and zoom rates, a matching template is established to realize the fast and accurate matching of textureless circular features and complex light fields. The EPnP algorithm is employed to obtain the pose information, and an AUBO-i5 robot is used to complete the charging gun insertion. The results show that the average CP positioning errors (x, y, z, Rx, Ry, and Rz) of the proposed algorithm are 0.65 mm, 0.84 mm, 1.24 mm, 1.11 degrees, 0.95 degrees, and 0.55 degrees. Further, the efficiency of the positioning method is improved by 510.4% and the comprehensive plug-in success rate is 95%. Therefore, the proposed CTMA in this paper can efficiently and accurately identify the CP while meeting the actual plug-in requirements.
A 12-b Subranging SAR ADC Using Detect-and-Skip Switching and Mismatch Calibration for Biopotential Sensing Applications
Authors: Nguyen Cong Luong , Phan Huu Nhan , Lee Jong-Wook
Published: May 2022

This paper presents a 12-b successive approximation register (SAR) analog-to-digital converter (ADC) for biopotential sensing applications. To reduce the digital-to-analog converter (DAC) switching energy of the high-resolution ADC, we combine merged-capacitor-switching (MCS) and detect-and-skip (DAS) methods, successfully embedded in the subranging structure. The proposed method saves 96.7% of switching energy compared to the conventional method. Without an extra burden on the realization of the calibration circuit, we achieve mismatch calibration by reusing the on-chip DAC. The mismatch data are processed in the digital domain to compensate for the nonlinearity caused by the DAC mismatch. The ADC is realized using a 0.18 μm CMOS process with a core area of 0.7 mm2. At the sampling rate fS = 9 kS/s, the ADC achieves a signal-to-noise ratio and distortion (SINAD) of 67.4 dB. The proposed calibration technique improves the spurious-free dynamic range (SFDR) by 7.2 dB, resulting in 73.5 dB. At an increased fS = 200 kS/s, the ADC achieves a SINAD of 65.9 dB and an SFDR of 68.8 dB with a figure-of-merit (FoM) of 13.2 fJ/conversion-step.
Development of a Cost-Based Design Model for Spread Footings in Cohesive Soils
Authors: Nawaz Muhammad Muneeb , Khan Shah Rukh , Farooq Rashid , Nawaz Muhammad Naqeeb , Khan Jamil , Tariq Muhammad Atiq Ur Rehman , Tufail Rana Faisal , Farooq Danish , Ng Anne W. M.
Published: May 2022

The use of cost-effective construction design approaches is an emerging concept in the field of sustainable environments. The design of the foundation for the construction of any infrastructure-related building entails three basic requirements, i.e., serviceability limit state (SLS), ultimate limit state (ULS), and economics. Engineering economy coupled with safety are the two main essentials for a successful construction project. The conventional design approaches are based on hit and trial methods to approach cost-effective design. Additionally, safety requirements are prioritized over the economic aspect of foundation design and do not consider safety requirements and cost simultaneously. This study presents a design approach that considers foundation construction costs while satisfying all the technical requirements of a shallow foundation design. This approach is called an optimization process in which the cost-based isolated foundation design charts were developed based on the field SPT N data. The design charts are the first of their kind for the robust design of foundations and can be used to compare the economic impact of different bearing capacity models. Furthermore, the design framework considers the quantitative impact of the different applied factors of safety values in terms of cost. The results show that Vesic’s equation yields higher values of bearing capacities than Terzaghi and Meyerhof. On the other hand, Vesic’s theory offers a 37.5% reduction in cost as compared to the conventional design approach of the foundation for isolated footing.