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Highlights The advantages of biomass materials for electromagnetic interference (EMI) shielding are analyzed, the mechanism of EMI shielding is summarized, and the factors affecting EMI shielding are analyzed systematically. Various biomass materials (wood, bamboo, lignin, cellulose) were modified to obtain unique structures and improve EMI shielding performance. The problems encountered in the application of biomass materials for EMI shielding are summarized, and the potential development and application in the future are prospected.

In investigating sustainable methodologies for removing recalcitrant organic pollutants from wastewater, visible-light-responsive photocatalysis has drawn considerable interest. Therefore, intentionally engineered photocatalysts with enhanced solar-light-absorption capacity and boosted charge carrier’s separation are highly demanded. In the present attempt, pure cobalt ferrite (CoFe2O4) and its fluorine-doped counterpart (F-CoFe2O4) were fabricated via co-precipitation. The fluorine-doped material was integrated into the 2D MXene to design the composite (F-CoFe2O4@MXene) by the ultrasonication method. The structure, surface morphology, chemical composition, and optical properties of the as-prepared catalysts were characterized by various techniques, including powder XRD, FTIR, SEM, EDS, UV–vis absorption, and photoluminescence spectroscopy. The photocatalytic potential was estimated by degrading crystal violet (CV) dye and benzoic acid (BA), which were selected as model pollutants. The composite material showcases significantly enhanced catalytic efficiency relative to the pure and doped materials. Under solar light exposure for 140 min, 91 % (0.0138 min−1) and 87 % (0.0133 min−1) of CV and BA degradation were achieved, respectively. The remarkable catalytic potential of the composite material corresponds to the fluorine doping and integration to the 2D MXene, which has enhanced its visible-light absorption and lowered the rapid recombination rate of the separated charges (e-/h+). Systematic studies, including reaction kinetics, dominating catalytic species in photodegradation, and stability of the catalyst, were followed through to disclose the photocatalytic potential of the designed F-CoFe2O4@MXene. Furthermore, the real-time applicability of the catalyst has been explored.

Textile industry waste such as methylene blue can pose a serious threat to health and ecosystems. One solution to overcome this problem is to utilize photocatalytic technology using TiO2 semiconductors. This research aims to make green synthetic TiO2 nanoparticles (NPs) using red spinach (Amaranthus Tricolor L.) leaf extract and used for photodegradation of methylene blue. Extraction of red spinach leaves showed that 30 min and a temperature of 95°C showed the highest phenolic content. In this research, several phenolic compounds were also identified in red spinach extract. For TiO2 NPs, the X-ray diffraction results show that TiO2 has a pure anatase phase. Electron microscope results show that TiO2 has the shape of agglomerated spherical clusters. The particle size distribution shows that TiO2 has an average size range of 77–90 nm. The methylene blue photodegradation showed that TiO2 had an efficiency of 90.36% for 180 min, higher than commercial TiO2 Evonic. This result can be attributed to the small particle size and broadband spectra so that photocatalysis is more effective.

Highlights The SiO2 nanofiber membranes and MXene@c-MWCNT6:4 as one unit layer (SMC1) were bonded together with 5 wt% PVA solution. When the structural unit is increased to three layers, the resulting SMC3 has an average electromagnetic interference SET of 55.4 dB and a low thermal conductivity of 0.062 W m−1 K−1. SMCx exhibit stable electromagnetic interference shielding and excellent thermal insulation even in extreme heat and cold environment.

Entropy generation in nanofluid flows is a critical parameter that influences the performance, efficiency, and sustainability of thermal systems. Understanding and optimizing entropy creation can lead to noteworthy advancements in numerous engineering applications, from renewable energy systems to industrial processes and biomedical equipments. The purpose of this article is to examine the entropy produced in the bioconvection flow of Eyring-Powell nanomaterial with gyrotactic microorganisms. The mathematical equations representing the flow are modeled considering the flow towards a porous surface of a cylinder. Together with the effects of the governing parameters, the mass and heat transfer components of the problem are discussed. The thermal effects of different natures are used in a new way. Overall, entropy creation is designed with regard to the second law of thermodynamics. Activation energy, chemical reaction, thermal radiation, and internal friction force effects are accounted for the development of the mathematical model. Coupled non-linear dimensional equations have been altered into ordinary differential equations (ODEs) and then treated using the MATLAB Finite Difference Method (FDM). Consequence of diverse sundry parameters on entropy production, thermal field, mass concentration profile, Bejan quantity, and motile density of microorganisms is deliberated via plots. Through tables, engineering quantities are analyzed. According to the findings, the velocity profile rises as the curvature and Eyring-Powell fluid parameters rise, while it falls when the magnetic parameter is enhanced. Additionally, it is noted that as the curvature variable enhances, the rate of heat transfer and skin friction coefficient decays.

A facile one-step non-contact process was developed for preparing the substrates for Fabry-Perot-based side-polished optical fiber sensors. A carbon dioxide (CO2) laser cladding removal technique was used to control the profile of the polished fiber surface and to introduce two reflective cavities. The substrates were characterized for a range of cavity lengths and their thermal response was studied. This device added a degree of freedom to the design of optical fiber based Fabry-Perot sensors and its potential was demonstrated by coating the substrate with polydimethylsiloxane (PDMS). The resulting sensors had a three-order of magnitude increase in sensitivity when compared to the substrate. The polished flat surface provided a route for the integration of novel materials for sensing applications, particularly those where polarization control was vital for light-matter interaction, for example, low dimensional materials such as graphene or MXene. The inherent simplicity, mechanical stability, and scalability of this approach are important steps for the realization of practical devices of this type.

The purpose of this study was to synthesize ecofriendly nano-composite in which agricultural waste (seeds of Tamarindus indica) was used to synthesize tamarind seed polysaccharides (TSP) and its composite with copper nanoparticles (Cu-NPs) for the purpose of green and clean environment as well as reduction of green-house gases. Confirmation of extracted TSP, synthesized nanocomposite was carried out using FTIR, SEM, PXRD and EDX techniques. In FTIR analysis TSP gives a strong broad peak at 3331 cm−1 due to –OH group and in case of composite its intensity is reduced which might be due to the interactions between –OH and Cu+2 ions. SEM analysis gives that TSP have irregular and rough surface while Cu-NPs exhibited spherical morphology and composite showed clustering of spherical shape to rough surface. EDX analysis quantitatively represented copper having atomic ratio 0.57 % which confirms the synthesis of composite. Furthermore, synthesized composite demonstrated excellent antibacterial activity against gram-positive (S.aureus) and gram-negative bacteria (E.coli) even greater than standard medicine (ciprofloxacin). From this study it was revealed that agriculture waste can be utilized to make environment green as well as synthesized composite from agricultural waste seed also displayed excellent antimicrobial activities which directs that they can be utilized in medical field. This study aims to assess the antimicrobial properties of the nanocomposite, aiming to contribute to the development of effective antimicrobial agents. Through these objectives, the research seeks to bridge the gap between green technology and antimicrobial efficacy, offering a promising avenue for both environmental conservation and healthcare advancements.

The authors report a scheme for enhancing the photodegradation properties of TiO2 nanoparticles (TiO2 NPs) by controlling their structural phases through cations doping (cobalt and Sulfur). Cobalt-sulfur co-doped TiO2 nanoparticles were synthesized via a hydrothermal process, with sulfur content varying at levels of 0.69, 1.37, and 2.06 atomic percent (at. %), while maintaining a constant cobalt content of 0.2 at. %. Our finding shows that the methyl blue dye loaded with pure TiO2 degraded marginally in 120 min (⁓ 10.5%) while in the presence of an optimally doped sample (Co: 0.2 at. %, S 2.06 at. %), it degraded almost 93% for the same duration. The study explores the underlying physical mechanisms that contribute to the varying levels of photoactivity, and these mechanisms are found to be influenced by the valency of the doping agents. The findings of this study demonstrate that precise control over the formation of the anatase phase through doping enables the production of a remarkably efficient TiO2-based photocatalyst. Our results indicate great prospects in enhancing TiO2-based photocatalyst development chemically, a suitable approach for large-scale nanoparticle production for industrial applications.

With the increasing awareness of the serious pollution from the usage of fossil fuels and the fast advances of technologies, the usage of biomass has been increased significantly. In this review paper, the biomass serving as carbon precursors and the energy has been reviewed including lotus lives, wheat flour, fish scale, fish skin, wax gourd, etc. The formed carbon nanostructures are reviewed together with their applications including the treatment volatile organic compounds (VOCs), heavy metal ions from polluted water, spilled oil, fillers for advanced composites, etc. This paper gives the usage of biomass in a sustainable and green way.

Pb1−4.75xNd0.5xNi4xZrO3 (where x = 0.00, 0.01, 0.02, 0.03, 0.04 and 0.05) nanocrystals were synthesized through the micro-emulsion, a wet chemical route. The prepared samples were annealed at 700°C for 3 h. Nanocrystalline samples were characterized by various techniques like XRD (X-rays diffraction), FTIR (Fourier transform infrared spectroscopy), SEM (Scanning electron microscopy), dielectric properties, and dc-electrical resistivity. XRD analysis of synthesized nanocrystals confirmed the phase development of orthorhombic perovskite structure. The average measured size of nanocrystals was about 21 nm. Some other parameters like densities (bulk and X-rays) and porosity of the nanomaterials were also calculated from obtained XRD data. The obtained results showed the effect of dopant materials (Nd3+ and Ni2+ metal ions) incorporation. The FTIR spectra elucidated the intrinsic cations vibrations in the characteristic perovskite orthorhombic structure. The SEM results revealed that nano-grains were synthesized successfully and their average observed size was 60 nm. It was observed that with the addition of dopant material, the dielectric parameters like dielectric constant, loss factor, and conductivity were showed an overall decreasing trend. The average calculated value of the ac conductivity at the frequency of 3 GHz was observed as 1.45 × 10−2 (Ω-cm)−1. By using the current–voltage (I–V) characteristics, the dc-electrical resistivity was calculated in the range between 2.68 × 1010 and 4.82 × 1010 Ω-cm. The dc-electrical resistivity was increased with the increase of doping contents.

Abstract With the innovation of microelectronics technology, the heat dissipation problem inside the device will face a severe test. In this work, cellulose aerogel (CA) with highly enhanced thermal conductivity (TC) in vertical planes was successfully obtained by constructing a vertically aligned silicon carbide nanowires (SiC NWs)/boron nitride (BN) network via the ice template-assisted strategy. The unique network structure of SiC NWs connected to BN ensures that the TC of the composite in the vertical direction reaches 2.21 W m−1 K−1 at a low hybrid filler loading of 16.69 wt%, which was increased by 890% compared to pure epoxy (EP). In addition, relying on unique porous network structure of CA, EP-based composite also showed higher TC than other comparative samples in the horizontal direction. Meanwhile, the composite exhibits good electrically insulating with a volume electrical resistivity about 2.35 × 1011 Ω cm and displays excellent electromagnetic wave absorption performance with a minimum reflection loss of − 21.5 dB and a wide effective absorption bandwidth (

A significant issue in developing metal-catalyzed plastic polymer materials is obtaining distinctive catalytic characteristics to compete with current plastics in industrial commodities. We performed first-principle DFT calculations on the key insertion steps for industrially important monomers, vinyl fluoride (VF) and 3,3,3-trifluoropropene (TFP), to explain how the ligand substitution patterns affect the complex’s polymerization behaviors. Our results indicate that the favorable 2,1-insertion of TFP is caused by less deformation in the catalyst moiety of the complexes in contrast to the 1,2-insertion mode. In contrast to the VF monomer, the additional interaction between the fluorine atoms of 3,3,3-trifluoropropene and the carbons of the catalyst ligands also contributed to favor the 2,1-insertion. It was found that the regioselectivity of the monomer was predominated by the progressive alteration of the catalytic geometry caused by small dihedral angles that were developed after the ligand–monomer interaction. Based on the distribution of the 1,2- and 2,1-insertion products, the activity and selectivity were influenced by the steric environment surrounding the palladium center; thus, an increased steric bulk visibly improved the selectivity of the bulkier polar monomer (TFP) during the copolymerization mechanism. In contrast, better activity was maintained through a sterically less hindered Pd metal center; the calculated moderate energy barriers showed that a catalyst with less steric hindrance might provide an opportunity for a wide range of prospective industrial applications.

Antigenic changes in surface proteins of the influenza virus may cause the emergence of new variants that necessitate the reformulation of influenza vaccines every year. Universal influenza vaccine that relies on conserved regions can potentially be effective against all strains regardless of any antigenic changes and as a result, it can bring enormous public health impact and economic benefit worldwide. Here, a conserved peptide (HA288–107) on the stalk domain of hemagglutinin glycoprotein is identified among highly pathogenic influenza viruses. Five top-ranked B-cell and twelve T-cell epitopes were recognized by epitope mapping approaches and the corresponding Human Leukocyte Antigen alleles to T-cell epitopes showed high population coverage (>99%) worldwide. Moreover, molecular docking analysis indicated that VLMENERTL and WTYNAELLV epitopes have high binding affinity to the antigen-binding groove of the HLA-A*02:01 and HLA-A*68:02 molecules, respectively. Theoretical physicochemical properties of the peptide were assessed to ensure its thermostability and hydrophilicity. The results suggest that the HA288–107 peptide can be a promising antigen for universal influenza vaccine design. However, in vitro and in vivo analyses are needed to support and evaluate the effectiveness of the peptide as an immunogen for vaccine development.

Antibiotic resistance in uropathogens has increased substantially and severely affected treatment of urinary tract infections (UTIs). Lately, some new formulations, including meropenem/vaborbactam (MEV), ceftazidime/avibactam (CZA), and ceftolozane/tazobactam (C/T) have been introduced to treat infections caused by drug-resistant pathogens. This study was designed to screen Enterobacteriales isolates from UTI patients and to assess their antimicrobial resistance pattern, particularly against the mentioned (new) antibiotics. Phenotypic screening of extended-spectrum β-lactamase (ESBL) and carbapenem resistance was followed by inhibitor-based assays to detect K. pneumoniae carbapenemase (KPC), metallo-β-lactamase (MBL), and class D oxacillinases (OXA). Among 289 Enterobacteriales, E. coli (66.4%) was the most predominant pathogen, followed by K. pneumoniae (13.8%) and P. mirabilis (8.3%). The isolates showed higher resistance to penicillins and cephalosporins (70–87%) than to non-β-lactam antimicrobials (33.2–41.5%). NDM production was a common feature among carbapenem-resistant (CR) isolates, followed by KPC and OXA. ESBL producers were susceptible to the tested new antibiotics, but NDM-positive isolates appeared resistant to these combinations. KPC-producers showed resistance to only C/T. ESBLs and carbapenemase encoding genes were located on plasmids and most of the genes were successfully transferred to recipient cells. This study revealed that MEV and CZA had significant activity against ESBL and KPC producers.

The present study is aimed at adsorptive removal of Mercury (Hg2+) using highly functionalized nanomaterials based on Graphene Oxide Zeolitic Imidazolate Framework composite (ZIF-67@GO). Solvothermal methodology was used to synthesize ZIF-67@GO composite. Synthesized compounds were confirmed by FTIR, SEM, PXRD and EDX analysis. The as-prepared ZIF-67@GO was tested as efficient adsorbent for effective removal of Mercury (Hg2+) from aquatic environment. The atomic adsorption spectrophotometer was used to monitor the process of adsorption of Hg+2 on ZIF-67@GO. From the adsorption data, the maximum removal efficiency achieved was 91.1% using 10 mg amount of composite for 50 mL using 20 ppm Mercury (Hg2+) solution. Different parameters like pH, contact time, concentration, adsorption kinetics and isotherm were also examined to explore adsorption process. Adsorption data fitted well for Freundlich Model having R2 value of 0.9925 than Langmuir Isotherm with R2 value of 0.9238. Kinetics were rapid and excellently described via 2nd order model with R2 = 0.99946 than 1st order model with R2 value of 0.8836. Freundlich and pseudo 2nd order models validated that multilayer chemisorption occurs during adsorption process due to the presence of highly functionalized sites on ZIF-67@GO composite. The synthesized composite material has shown excellent reusability. Thus, water stable ZIF-67@GO composites can efficiently be used for Mercury (Hg2+) confiscation from water.

Strontium-substituted spinel ferrites were prepared using the sol–gel method. The sample’s chemical formula was Cu1–xSrxFe2O4 (0.00, 0.20, 0.40, 0.60, 0.80 and 1.00). A cubic structure was discovered through X-ray diffraction (XRD) analysis. The lattice, constant, X-ray density and other structural parameters were increased with the substitution of strontium ion due to its larger ionic radius as compared with the ionic radius of manganese. It was discovered that the addition of strontium ions increased both activation energy and dc resistivity, whilst the decrease in resistivity with increasing temperature proved the semiconducting nature of samples. There was an abysmal disparity between the coerciveness and magnetization values. The permittivity was decreased with the addition of strontium ions. The low perittivity and high specific resistance suggested that prepared samples are suitable for high-frequency applications.

The spinel ferrites have been manufacturing long time because of their variety of applications in technological and industrial field. In the following study, the samarium doped spinel ferrites were under examination. The prepared compositions were denoted as; SrSmxFe2–xO4, x = 0, 0.025, 0.05, 0.075, 0.10. Sol–gel procedure was employed to make these samples. All the samples were investigated through the X-ray diffraction technique. The phase of prepared product was detected for the first three samples. However, the orthorhombic phase, that is, SmFeO3, was traced when samarium (Sm) composition reached 0.075 and above. The smaller width of the M–H loop confirmed the formation of soft ferrites. Saturation and remanence values were diminished with the substitution of samarium ions. But the anisotropy constant as well as coercivity values was enhanced with the samarium contents. Above mentioned features of spinel ferrites showed their possible usage in high-density recording applications.

The crystallinity properties of perovskite influence their optoelectrical performance in solar cell applications. We optimized the grain shape and crystallinity of perovskite film by annealing treatment from 130 to 170 °C under high humidity (relative humidity of 70%). We found that the grain size, grain interface, and grain morphology of the perovskite are optimized when the sample was annealed at 150 °C for 1 h in the air. At this condition, the perovskite film is composed of 250 nm crystalline shape grain and compact inter-grain structure with an invincible grain interface. Perovskite solar cells device analysis indicated that the device fabricated using the samples annealed at 150 °C produced the highest power conversion efficiency, namely 17.77%. The open circuit voltage (Voc), short-circuit current density (Jsc), and fill factor (FF) of the device are as high as 1.05 V, 22.27 mA/cm2, and 0.76, respectively. Optoelectrical dynamic analysis using transient photoluminescence and electrochemical impedance spectroscopies reveals that (i) carrier lifetime in the champion device can be up to 25 ns, which is almost double the carrier lifetime of the sample annealed at 130 °C. (ii) The interfacial charge transfer resistance is low in the champion device, i.e., ~20 Ω, which has a crystalline grain morphology, enabling active photocurrent extraction. Perovskite’s behavior under annealing treatment in high humidity conditions can be a guide for the industrialization of perovskite solar cells.

Layered double hydroxides (LDH) are regarded as attractive pseudocapacitive materials due to their impressive capacitive qualities that may be adjustable to their morphological features. However, the layered structure of LDH renders them susceptible to structural aggregation, which inhibits effective electrolyte transport and limits their practical applicability after limited exposure to active areas. Herein, we propose a simple template-free strategy to synthesize hierarchical hollow sphere NiMn-LDH material with high surface area and exposed active as anode material for supercapacitor application. The template-free approach enables the natural nucleation of Ni-Mn ions resulting in thin sheets that self-assemble into a hollow sphere, offering expended interlayer spaces and abundant redox-active active sites. The optimal NiMn-LDH-12 achieved a specific capacitance of 1010.4 F g−1 at a current density of 0.2 A g−1 with capacitance retention of 70% at 5 A g−1 after 5000 cycles with lower charge transfer impedance. When configured into an asymmetric supercapacitors (ASC) device as NiMn-LDH//AC, the material realized a specific capacitance of 192.4 F g−1 at a current density of 0.2 A g−1 with a good energy density of 47.9 Wh kg−1 and a power density of 196.8 W kg−1. The proposed morphological-tuning route is promising for designing template-free NiMn-LDHs spheres with practical pseudocapacitive characteristics.

Plants of the genus Strobilanthes have notable use in folklore medicines as well as being used for pharmacological purposes. The present work explored the biological predispositions of Strobilanthes glutinosus and attempted to accomplish a comprehensive chemical profile through GC-MS of different fractions concerning polarity (chloroform and n-butanol) and LC-ESI-MS of methanolic extract by both positive and negative ionization modes. The biological characteristics such as antioxidant potential were assessed by applying six different methods. The potential for clinically relevant enzyme (α-amylase, α-glucosidase, and tyrosinase) inhibition was examined. The DPPH, ABTS, CUPRAC, and FRAP results revealed that the methanol fraction presented efficient results. The phosphomolybdenum assay revealed that the n-hexane fraction showed the most efficient results, while maximum metal chelation potential was observed for the chloroform fraction. The GC-MS profiling of n-butanol and chloroform fractions revealed the existence of several (110) important compounds presenting different classes (fatty acids, phenols, alkanes, monoterpenes, diterpenes, sesquiterpenoids, and sterols), while LC-ESI-MS tentatively identified the presence of 44 clinically important secondary metabolites. The n-hexane fraction exhibited the highest potential against α-amylase (497.98 mm ACAE/g extract) and α-glucosidase (605.85 mm ACAE/g extract). Significant inhibitory activity against tyrosinase enzyme was displayed by fraction. Six of the prevailing compounds from the GC-MS study (lupeol, beta-amyrin, stigmasterol, gamma sitosterol, 9,12-octadecadienoic acid, and n-hexadecanoic acid) were modelled against α-glucosidase and α-amylase enzymes along with a comparison of binding affinity to standard acarbose, while three compounds identified through LC-ESI-MS were docked to the mushroom tyrosinase enzyme and presented with significant biding affinities. Thus, it is assumed that S. glutinosus demonstrated effective antioxidant and enzyme inhibition prospects with effective bioactive molecules, potentially opening the door to a new application in the field of medicine.

The worldwide spread and increasing prevalence of carbapenem-resistant Enterobacteriaceae (CRE) is of utmost concern and a problem for public health. This resistance is mainly conferred by carbapenemase production. Such strains are a potential source of outbreaks in healthcare settings and are associated with high rates of morbidity and mortality. In this study, we aimed to determine the dominance of NDM-producing Enterobacteriaceae at a teaching hospital in Karachi. A total of 238 Enterobacteriaceae isolates were collected from patients admitted to Jinnah Postgraduate Medical Centre (Unit 4) in Karachi, Pakistan, a tertiary care hospital. Phenotypic and genotypic methods were used for detection of metallo-β-lactamase. Out of 238 isolates, 52 (21.8%) were CRE and 50 isolates were carbapenemase producers, as determined by the CARBA NP test; two isolates were found negative for carbapenemase production by CARB NP and PCR. Four carbapenemase-producing isolates phenotypically appeared negative for metallo-β-lactamase (MBL). Of the 52 CRE isolates, 46 (88.46%) were blaNDM positive. Most of the NDM producers were Klebsiella pneumoniae, followed by Enterobacter cloacae and Escherichia coli. In all the NDM-positive isolates, the blaNDM gene was found on plasmid. These isolates were found negative for the VIM and IPM MBLs. All the CRE and carbapenem-sensitive isolates were sensitive to colistin. It is concluded that the NDM is the main resistance mechanism against carbapenems and is dominant in this region.

Tapioca processing industries are very popular in the rural community to produce a variety of foods as the end products. Due to their small scales and scattered locations, they require robust modular systems to operate at low capacity with minimum supervision. This study explores the application of a novel sequencing batch-integrated fixed-film activated sludge membrane (SB-IFASM) process to treat tapioca processing wastewater for reuse purposes. The SB-IFASM employed a gravity-driven system and utilizes biofilm to enhance biodegradation without requiring membrane cleaning. The SB-IFASM utilizes the biofilm as a secondary biodegradation stage to enhance the permeate quality applicable for reuse. A lab-scale SB-IFASM was developed, preliminarily assessed, and used to treat synthetic tapioca processing industry wastewater. The results of short-term filtration tests showed the significant impact of hydrostatic pressure on membrane compaction and instant cake layer formation. Increasing the pressure from 2.2 to 10 kPa lowered the permeability of clean water and activated sludge from 720 to 425 and from 110 to 50 L/m2·h bar, respectively. The unsteady-state operation of the SB-IFASM showed the prominent role of the bio-cake in removing the organics reaching the permeate quality suitable for reuse. High COD removals of 63–98% demonstrated the prominence contribution of the biofilm in enhancing biological performance and ultimate COD removals of >93% make it very attractive for application in small-scale tapioca processing industries. However, the biological ecosystem was unstable, as shown by foaming that deteriorated permeability and was detrimental to the organic removal. Further developments are still required, particularly to address the biological stability and low permeability.

This article describes the design and synthesis of a series of novel amantadine-thiourea conjugates (3a–j) as Jack bean urease inhibitors. The synthesized hybrids were assayed for their in vitro urease inhibition. Accordingly, N-(adamantan-1-ylcarbamothioyl)octanamide (3j) possessing a 7-carbon alkyl chain showed excellent activity with IC50 value 0.0085 ± 0.0011 µM indicating that the long alkyl chain plays a vital role in enzyme inhibition. Whilst N-(adamantan-1-ylcarbamothioyl)-2-chlorobenzamide (3g) possessing a 2-chlorophenyl substitution was the next most efficient compound belonging to the aryl series with IC50 value of 0.0087 ± 0.001 µM. The kinetic mechanism analyzed by Lineweaver–Burk plots revealed the non-competitive mode of inhibition for compound 3j. Moreover, in silico molecular docking against target protein (PDBID 4H9M) indicated that most of the synthesized compounds exhibit good binding affinity with protein. The compound 3j forms two hydrogen bonds with amino acid residue VAL391 having a binding distance of 1.858 Å and 2.240 Å. The interaction of 3j with amino acid residue located outside the catalytic site showed its non-competitive mode of inhibition. Based upon these results, it is anticipated that compound 3j may serve as a lead structure for the design of more potent urease inhibitors.

Partially biodegradable polymer nanocomposites Poly(3-Hydroxybutyrate) (PHB)/MultiwalledCarbon Nanotubes (MWCNTs)/Poly(Methyl Methacrylate) (PMMA)and non-biodegradable nanocomposites (MWCNTs/PMMA) were synthesized, and their thermal, electrical, and ammonia-sensing properties were compared. MWCNTs were chemically modified to ensure effective dispersion in the polymeric matrix. Pristine MWCNTs (p-MWCNTs) were functionalized with –COOH (a-MWCNTs) and amine groups (f-MWCNTs). Then, PHB grafted multiwalled carbon nanotubes (g-MWNTs) were prepared by a ‘grafting to’ technique. The p-MWCNTs, a-MWCNTs, f-MWCNTs, and g-MWCNTs were incorporated into the PMMA matrix and PMMA/PHB blend system by solution mixing. The PHB/f-MWCNTs/PMMA blend system showed good thermal properties among all synthesized nanocomposites. Results from TGA and dTGA analysis for PHB/f-MWCNTs/PMMA showed delay in T5 (about 127 °C), T50 (up to 126 °C), and Tmax (up to 65 °C) as compared to neat PMMA. Higher values of frequency capacitance were observed in nanocomposites containing f-MWCNTs and g-MWCNTs as compared to nanocomposites containing p-MWCNTs and a-MWCNTs. This may be attributed to their excellent interaction and good dispersion in the polymeric blend. Analysis of ammonia gas-sensing data showed that PHB/g-MWCNTs/PMMA nanocomposites exhibited good sensitivity (≈100%) and excellent repeatability with a constant response. The calculated limit of detection (LOD) is 0.129 ppm for PHB/g-MWCNTs/PMMA, while that of all other nanocomposites is above 40 ppm.

The adsorption of dyes using 39 adsorbents (16 kinds of agro-wastes) were modeled using random forest (RF), decision tree (DT), and gradient boosting (GB) models based on 350 sets of adsorption experimental data. In addition, the correlation between variables and their importance was applied. After comprehensive feature selection analysis, five important variables were selected from nine variables. The RF with the highest accuracy (R2 = 0.9) was selected as the best model for prediction of adsorption capacity of agro-waste using the five selected variables. The results suggested that agro-waste characteristics (pore volume, surface area, agro-waste pH, and particle size) accounted for 50.7% contribution for adsorption efficiency. The pore volume and surface area are the most important influencing variables among the agro-waste characteristics, while the role of particle size was inconspicuous. The accurate ability of the developed models’ prediction could significantly reduce experimental screening efforts, such as predicting the dye removal efficiency of agro-waste activated carbon according to agro-waste characteristics. The relative importance of variables could provide a right direction for better treatments of dyes in the real wastewater.

Titanium dioxide (TiO2) has been widely applied as a photocatalyst for wastewater treatment due to its high photocatalytic activity and it can remove various harmful organic pollutants effectively. Under heated system, however, TiO2 is prone to agglomeration that decrease its abilities as a photocatalyst. In order to overcome the agglomeration and increase its thermal resistance, addition of silica (SiO2) as supporting material is proposed in this research. Silica or silicon dioxide can be extracted from natural resources such as beach sand. Here, we report the application of a composite photocatalyst of TiO2/SiO2 to remove phenolic compounds in wastewater. The photocatalyst was synthesized by adding SiO2 from beach sand onto TiO2 through impregnation methods. The results of the X-ray diffraction (XRD) showed that TiO2 was present in the anatase phase. The highest crystallinity was obtained by TiO2/SiO2 ratios of 7:1. SEM results showed that the shape of the particles was spherical. Further characterizations were conducted using Fourier-transform infrared spectroscopy (FTIR), Brunauer–Emmett–Teller (BET) analysis, and a particle size analyzer (PSA). By using the optimized condition, 96.05% phenol was degraded by the synthesized photocatalyst of TiO2/SiO2, under UV irradiation for 120 min. The efficiency of the TiO2/SiO2 is 3.5 times better than commercial TiO2 P25 for the Langmuir–Hinshelwood first-order kinetic model.

The physical properties, such as the fibre dimension and crystallinity, of cellulose nanofibre (CNF) are significant to its functional reinforcement ability in composites. This study used supercritical carbon dioxide as a fibre bundle defibrillation pretreatment for the isolation of CNF from bamboo, in order to enhance its physical properties. The isolated CNF was characterised through zeta potential, TEM, XRD, and FT-IR analysis. Commercial CNF was used as a reference to evaluate the effectiveness of the method. The physical, mechanical, thermal, and wettability properties of the bamboo and commercial CNF-reinforced PLA/chitin were also analysed. The TEM and FT-IR results showed the successful isolation of CNF from bamboo using this method, with good colloidal stability shown by the zeta potential results. The properties of the isolated bamboo CNF were similar to the commercial type. However, the fibre diameter distribution and the crystallinity index significantly differed between the bamboo and the commercial CNF. The bamboo CNF had a smaller fibre size and a higher crystallinity index than the commercial CNF. The results from the CNF-reinforced biocomposite showed that the physical, mechanical, thermal, and wettability properties were significantly different due to the variations in their fibre sizes and crystallinity indices. The properties of bamboo CNF biocomposites were significantly better than those of commercial CNF biocomposites. This indicates that the physical properties (fibre size and crystallinity) of an isolated CNF significantly affect its reinforcement ability in biocomposites. The physical properties of isolated CNFs are partly dependent on their source and production method, among other factors. These composites can be used for various industrial applications, including packaging.