Strength Of Solution Research Articles

Molecular dynamics simulations unveil the aggregation patterns and salting out of polyarginines at zwitterionic POPC bilayers in solutions of various ionic strengths

This study employs molecular dynamics (MD) simulations to investigate the adsorption and aggregation behavior of simple polyarginine cell-penetrating peptides (CPPs), specifically modeled as R9 peptides, at zwitterionic phosphocholine POPC membranes under varying ionic strengths of two peptide concentrations and two concentrations of NaCl and CaCl2. The results reveal an intriguing phenomenon of R9 aggregation at the membrane, which is dependent on the ionic strength, indicating a salting-out effect. As the peptide concentration and ionic strength increase, peptide aggregation also increases, with aggregate lifetimes and sizes showing a corresponding rise, accompanied by the total decrease of adsorbed peptides at the membrane surface. Notably, in high ionic strength environments, large R9 aggregates, such as octamers, are also observed occasionally. The salting-out, typically uncommon for short positively charged peptides, is attributed to the unique properties of arginine amino acid, specifically by its side chain containing amphiphilic guanidinium (Gdm+) ion which makes both intermolecular hydrophobic like-charge Gdm+ – Gdm+ and salt-bridge Gdm+ – C-terminus interactions, where the former are increased with the ionic strength, and the latter decreased due to electrostatic screening. The aggregation behavior of R9 peptides at membranes can also be linked to their CPP translocation properties, suggesting that aggregation may aid in translocation across cellular membranes.

Binding of a Tricationic meso-Substituted Porphyrin to poly(A)⋅poly(U): an Experimental Study.

The porphyrins are macrocyclic compounds widely used as photosensitizers in anticancer photodynamic therapy. The binding of a tricationic meso-tris(N-methylpyridinium)-porphyrin, TMPyP3+, to poly(A)⋅poly(U) polynucleotide has been studied in neutral buffered solution, pH6.9, of low and near-physiological ionic strength in a wide range of molar phosphate-to-dye ratios (P/D). Effective TMPyP3+ binding to the biopolymer was established using absorption spectroscopy, polarized fluorescence, fluorimetric titration and resonance light scattering. We propose a model in which TMPyP3+ binds to the polynucleotide in two competitive binding modes: at low P/D ratios (< 4) external binding of the porphyrin to polynucleotide backbone without self-stacking dominates, and at higher P/D (> 30) the partially stacked porphyrin J-dimers are embedded into the polymer groove. Enhancement of the porphyrin emission was observed upon binding in all P/D range, contrasting the binding of this porphyrin to poly(G)⋅poly(C) with significant quenching of the porphyrin fluorescence at low P/D ratios. This observation indicates that TMPyP3+ can discriminate between poly(A)⋅poly(U) and poly(G)⋅poly(C) polynucleotides at low P/D ratios. Formation of highly scattering extended porphyrin aggregates was observed near the stoichiometric in charge binding ratio, P/D = 3. It was revealed that the efficiency of the porphyrin external binding and aggregation is reduced in the solution of near-physiological ionic strength.

Preferential Binding of Cations Modulates Electrostatically Driven Protein Aggregation and Disaggregation.

Protein aggregation resulting in either ordered amyloids or amorphous aggregates is not only restricted to deadly human diseases but also associated with biotechnological challenges encountered in the therapeutic and food industries. Elucidating the key structural determinants of protein aggregation is important to devise targeted inhibitory strategies, but it still remains a formidable task owing to the underlying hierarchy, stochasticity, and complexity associated with the self-assembly processes. Additionally, alterations in solution pH, salt types, and ionic strength modulate various noncovalent interactions, thus affecting the protein aggregation propensity and the aggregation kinetics. However, the molecular origin and a detailed understanding of the effects of weakly and strongly hydrated salts on protein aggregation and their plausible roles in the dissolution of aggregates remain elusive. In this study, using fluorescence and circular dichroism spectroscopy in combination with electron microscopy and light scattering techniques, we show that the ionic size, valency, and extent of hydration of cations play a crucial role in regulating the protein aggregation and disaggregation processes, which may elicit unique methods for governing the balance between protein self-assembly and disassembly.

ATP-induced reconfiguration of the micro-viscoelasticity of cardiac and skeletal myosin solutions.

We study the high-frequency, micro-mechanical response of suspensions composed of cardiac and skeletal muscle myosin by optical trapping interferometry. We observe that in low ionic strength solutions, upon the addition of magnesium adenosine triphosphate (MgATP2-), myosin suspensions radically change their micro-mechanics properties, generating a viscoelastic fluid characterized by a complex modulus similar to a suspension of worm-like micelles. This transduction of energy, from chemical to mechanical, may be related to the relaxed states of myosin, which regulate muscle contractility and can be involved in the etiology of many myopathies. Within an analogous generic mechanical response, cardiac and skeletal myosin suspensions provide different stress relaxation times, elastic modulus values, and characteristic lengths. These discrepancies probably rely on the dissimilar physiological functions of cardiac and skeletal muscle, on the different MgATPase hydrolysis rates of cardiac and skeletal myosins, and on the observed distinct cooperative behavior of their myosin heads in the super-relaxed state. In vitro studies like these allow us to understand the foundations of muscle cell mechanics on the micro-scale, and may contribute to the engineering of biological materials whose micro-mechanics can be activated by energy regulators.

Oxidative Dissolution and the Aggregation of Silver Nanoparticles in Drinking and Natural Waters: The Influence of the Medium on the Process Development.

Currently, there are quite a few data on the ways silver nanoparticles get into the aquatic environment, on their subsequent dissolution in water, and on the release of toxic Ag+ ions. Differences in the experimental conditions hinder the determination of the basic regularities of this process. In this study, the stages of oxidative dissolution of AgNPs were studied, starting from the formation of silver hydrosol in deaerated solution, the reaction of silver with oxygen and with drinking and natural waters, the analysis of intermediate species of the oxidized colloidal particles, and the subsequent particle aggregation and precipitation, by optical spectroscopy, DLS, TEM, STEM, and EDX. In the presence of oxygen, silver nanoparticles undergo oxidative dissolution, which gives Ag+ ions and results in the subsequent aggregation of nanoparticles. The carbonate hydrosol loses stability when mixed with waters of various origin. This is due to the destruction of the electric double layer, which is caused by an increase in the solution's ionic strength and the neutralization of the charge of the metal core. The environmental hazard of the silver nanoparticle hydrosol would noticeably change and/or decrease when the nanoparticles get into natural waters because of their fast precipitation and because the major part of released Ag+ ions form poorly soluble salts with ions present in water.

Activated carbons prepared from stump wood of various tree species by chemical activation and their application for water purification

AbstractActivated carbons (ACs) were produced from stump wood of different tree species, such as pine, bearded birch, and American black cherry using chemical activation with KOH and NaOH. The activated carbons were characterized and evaluated as adsorbents for eliminating bisphenol A (BPA) from aqueous solutions. The kinetics of adsorption and equilibrium adsorption, as well as the impact of solution pH and ionic strength, were examined. The kinetics were analyzed using the pseudo-first-order, pseudo-second-order, intra-particle diffusion, and Boyd kinetic models. The findings suggest that the adsorption kinetics followed the pseudo-second-order model. Additionally, the film diffusion was found to be the rate-determining step for the adsorption of BPA on all of the activated carbons. The data for adsorption equilibrium were tested using the Langmuir, Freundlich, and Sips equations, with results indicating that the Langmuir model was the most applicable. The capacity of activated carbons to adsorb BPA was dependent on their surface area. Higher BET surface areas resulted in increased adsorption. The birch-derived AC activated by NaOH had a monolayer adsorption capacity of 1.980 mmol/g, while the AC from black cherry activated with KOH had 2.195 mmol/g. The adsorption of BPA was pH-dependent, and no effect of ionic strength was observed. The activated carbons had very high adsorption capacities, indicating that stump wood is an excellent precursor for the production of highly effective adsorbents.

Transforming waste into multifunctional nanomaterials: Mg-doped carbon dots from cow dung for Y(III) detection and biomedical applications

Rare earth metal Yttrium (Y3+) plays a vital role in many electronic devices however, discarding these devices eventually contaminates the environmental sources. Herein, we have developed a Mg-doped carbon dots (M-CDs) as a fluorescent probe for selective and sensitive determination of Y3+ in water bodies. The M-CDs having maximum emission at 420 nm upon 310 nm excitation with 20 % quantum yield and which was synthesized from upcycling of agricultural waste i.e., cow dung by simple carbonization followed by hydrothermal method. M-CDs were confirmed using different analytical and characterization techniques as well as stable in different pH and ionic strength solutions. The M-CDs was highly selective towards Y3+ ions over different metal ions with significant blue shift. This fluorescent probe performs a good linear relationship between the different concentrations of Y3+ ion and fluorescence intensity (R2 = 0.99) within the range of 0.2 to 20 μg/mL with a detection limit of 0.019 µg/mL. The study indicates quenching of Y3+ was result of dynamic quenching and the Inner Filter Effect (IFE) effect. Also, the cytotoxicity of M-CDs was checked via CAM assay and significant growth in blood vascularization with healthy growth of chick embryo confirmed the M-CDs were biocompatible. The nontoxic M-CDs was employed for MCF-7 breast cancer cell imaging which gives bright blue fluoresce under UV light excitation. Further, aiming to a circular economy approach the residual carbon remaining after hydrothermal was used as reactivated carbon for the abatement of environmental pollutants. The sustainable, cost-effective and agricultural waste-derived Mg-doped CDs have potential applications in analytical, environmental, forensic as well as biomedical fields.

Entropy‐Driven Carbon Dioxide Capture: The Role of High Salinity and Hydrophobic Monoethanolamine

Addressing atmospheric CO2 levels during the transition to carbon neutrality requires efficient CO2 capture methods. Aqueous amine scrubbing dominates large‐scale flue gas capture but is hampered by the energy‐intensive regeneration step, sorbent loss, and consequent environmental concerns with volatile amines. Herein, hydrophobic non‐volatile alkylated monoethanolamine (MEA) is introduced as a water‐lean CO2 absorbent in brine. The effects of alkylation of MEA, salinity, and aggregation of absorbents on the improved CO2 capture process are systematically investigated. The CO2 absorption facilitates spontaneous self‐aggregation of hydrophobic absorbents, which increases the entropy of water in high‐ion strength solutions. This effect is controlled by the salinity of aqueous solutions, affording comparative gravimetric CO2 uptake performance to benchmark MEA. It is experimentally verified that the hydrophobicity of alkylated MEAs in saline water is responsible for facile absorption, and also for mild regeneration conditions. Therefore, the entropy‐driven approach minimizes absorbent evaporation, corrosion, and decomposition, thus paving the way to realize energy‐efficient carbon capture.

Harnessing wood bottom ash for efficient arsenic removal from wastewater: Adsorption mechanisms and process optimisation

This study explored the innovative application of wood bottom ash (WBA) as an adsorbent for arsenic (As) removal from wastewater, focusing on the adsorption mechanism and optimisation of the operational conditions. Comprehensive spectroscopic analyses, including FE-SEM/EDS, BET, XRF, XRD, FT-IR, and XPS, were performed to examine the elemental and mineralogical changes in WBA before and after As adsorption. The study assessed the adsorption kinetics and isotherms, revealing that As adsorption reached equilibrium within 48 h, with a maximum capacity of 121.13 mg/g. The adsorption process followed a pseudo-second-order kinetic model and aligned well with the Langmuir isotherm, indicating that the process is governed by chemisorption and occurs as monolayer adsorption. The primary removal mechanism was the surface precipitation of amorphous calcium arsenate. Response surface methodology was employed to analyse and optimise the factors influencing As removal, including solution pH, ionic strength, adsorbent dose and reaction time. The optimal conditions for maximum As removal were pH 7.11, 8.37 mM ionic strength, 9.08 g/L WBA dose, and 2.58 h reaction time. This study offers novel insights into the efficient and cost-effective use of WBA for As removal, highlighting its potential as a sustainable solution for wastewater treatment in developing countries.

Study of Insulin Aggregation and Fibril Structure under Different Environmental Conditions.

Protein amyloid aggregation is linked with widespread and fatal neurodegenerative disorders as well as several amyloidoses. Insulin, a small polypeptide hormone, is associated with injection-site amyloidosis and is a popular model protein for in vitro studies of amyloid aggregation processes as well as in the search for potential anti-amyloid compounds. Despite hundreds of studies conducted with this specific protein, the procedures used have employed a vast array of different means of achieving fibril formation. These conditions include the use of different solution components, pH values, ionic strengths, and other additives. In turn, this variety of conditions results in the generation of fibrils with different structures, morphologies and stabilities, which severely limits the possibility of cross-study comparisons as well as result interpretations. In this work, we examine the condition-structure relationship of insulin amyloid aggregation under a range of commonly used pH and ionic strength conditions as well as solution components. We demonstrate the correlation between the reaction solution properties and the resulting aggregation kinetic parameters, aggregate secondary structures, morphologies, stabilities and dye-binding modes.

Spectroscopic and solution properties characterization of quaternary ammonium ion containing polycations complexed with fluorescent rhodamine sulfonic acid dyes

Based on the growing range of applications for polycations in research and commercial materials, a continuing need exists to advance the fundamental knowledge and understanding of this class of materials. Spectroscopic and solution properties characterizations of noncovalently labeled, fluorescent Alexa Fluor® dye complexes of two commercial polycations, poly(2-(trimethylamino) ethyl methacrylate) monocation and poly[bis[2-chloroethyl] ether-alt-1,3-bis[3-(dimethylamino) propyl] urea] dication are reported to help address this need. A variety of fluorescence spectroscopic methods are used with a special emphasis on fluorescence correlation spectroscopy (FCS) which is applied to characterize the Stokes radius (RS) and equilibrium dissociation constants (Kd) of dye-polycation complexes at nanomolar dye concentrations. Resulting RS values indicate dye binding to individual polycation chains. Measured Kd values in the sub-micromolar range are consistent with strong dye binding. Increasing solution ionic strength with sodium chloride addition inhibits dye binding and decreases the RS of dye-polycation complexes due to size collapse of polycation chains. The complexes differ in their solution stability to ionic strength changes suggesting that both electrostatic and hydrophobic binding interactions influence dye binding. This study establishes the viability of noncovalent dye-polycation complexation in concert with FCS characterization as a general approach for investigating the properties of quaternary ammonium ion containing polycations in aqueous solution.

Withdrawal: Yang, M.-N., Zhang, Y.-F., Zhi, G.-Y., Gu, X.-F., Han, L. and Zhang, D-H. (2020), Fabricating cholyglycine-glucose-6-phosphate dehydrogenase conjugates for cholyglycine detection. Biotechnology and Applied Biochemistry. (Accepted Article): https://doi.org/10.1002/bab.1983.

To establish cholyglycine (CG) detection via enzyme multiplied immunoassay technique (EMIT), glucose-6-phosphate dehydrogenase (G6PD) was used as a reporter enzyme to prepare hapten-enzyme conjugate. Gel electrophoresis and UV scanning demonstrated that G6PD was successfully labeled with cholyglycine and CG-G6PD conjugate was obtained. Furthermore, the effects of various parameters on the preparation of CG-G6PD conjugates were investigated. Consequently, CG amount, NADH, D-glucose-6-phosphate (G6P), phosphate buffer and the pH, and ionic strength of solution had important effects on the residual activity of CG-G6PD. Moreover, CG amount, the pH, and G6P played important roles in changing CG labeling location on G6PD. Using the CG-G6PD conjugate as test kit, the cholyglycine-EMIT calibration curve was established, which could be employed in clinical detection of cholyglycine. This study provides some valuable information for preparing hapten-G6PD conjugates. This article is protected by copyright. All rights reserved.

Self-assembled α-lactalbumin nanostructures: encapsulation and controlled release of bioactive molecules in gastrointestinal in vitro model.

Implementing encapsulation techniques is pivotal in safeguarding bioactive molecules against environmental conditions for drug delivery systems. Moreover, the food-grade nanocarrier is a delivery system and food ingredient crucial in creating nutraceutical foods. Nano α-lactalbumin has been shown to be a promissory nanocarrier for hydrophobic molecules. Furthermore, the nanoprotein can enhance the tecno-functional properties of food such as foam and emulsion. The present study investigated the nanostructured α-lactalbumin protein (nano α-la) as a delivery and controlled release system for bioactive molecules in a gastric-intestinal in vitro mimic system. The nano α-la was synthesized by a low self-assembly technique, changing the solution ionic strength by NaCl and obtaining nano α-la 191.10 ± 21.33 nm and a spherical shape. The nano α-la showed higher encapsulation efficiency and loading capacity for quercetin than riboflavin, a potential carrier for hydrophobic compounds. Thermal analysis of nano α-la resulted in a ΔH of -1480 J g-1 for denaturation at 57.44 °C. The nanostructure formed by self-assembly modifies the foam volume increment and stability. Also, differences between nano and native proteins in emulsion activity and stability were noticed. The release profile in vitro showed that the nano α-la could not hold the molecules in gastric fluid. The Weibull and Korsmeyer-Peppas model better fits the release profile behavior in the studied fluids. The present study shows the possibility of nano α-la as an alternative to molecule delivery systems and nutraceutical foods' formulation because of the high capacity to encapsulate hydrophobic molecules and the improvement of techno-functional properties. However, the nanocarrier is not perfectly suitable for the sustainable delivery of molecules in the gastrointestinal fluid, demanding improvements in the nanocarrier. © 2024 Society of Chemical Industry.

Adsorption pathways of boron on clay and their implications for boron cycling on land and in the ocean

Reversible adsorption and isotope fractionation of boron on the surface of clay minerals is a key process that impacts boron isotope cycling in porewater, rivers and the ocean. However, the differences in boron isotope fractionation factors between various clay minerals and their dependence on fluid chemistry are not well known. We performed two sets of experiments, using solutions of pure water with added boron and seawater, to explore the isotope behavior during adsorption of boron onto kaolinite, smectite and illite. We found that the amount of sorbed boron increases with ionic strength of solutions and is proportional to the cation exchange capacity of a given clay mineral. Maximum adsorption is observed in alkaline seawater, which we attribute to the efficient fixation of magnesium-borate ion pairs onto negatively charged surface sites. Isotopic fractionation is modestly different between clays and demonstrates that clay surfaces preferentially sorb borate, even when the concentration of borate in solution is low. In both pure water and seawater, adsorbed complexes retain the isotopic composition of their dissolved precursors (borate or boric acid) with minimal isotopic fractionation. In other words, isotopic composition of adsorbed boron is set by the ability of clays to adsorb boron from an already fractionated boron pool rather than specific fractionation associated with the complexation reaction. Our experimental results allow us to provide revised constraints on the adsorbed boron being transported in terrestrial fluids and the ocean.

Thermodynamics, kinetic study and equilibrium isotherm analysis of cationic dye adsorption by ternary composite

This article investigates the kinetics, equilibrium, and thermodynamics of brilliant green dye adsorption on Fe3O4/CdS/MWCNTs. The effects of adsorbent dosage (0.01–0.06 g), contact time (1–120 min), temperature (278, 288,298 and 308 K), ionic strength (NaCl and CaCO3 salt), and initial solution pH (4,6,7, and 10) were all studied in relation to the adsorption of BG dye. Langmuir (R2 = 0.86883), Temkin (R2 = 0.96323) and Freundlich (R2 = 0.96958) and isotherms were fitted to describe the equilibrium of BG adsorption process. Isothermal models showed that BG adsorption was a favorable process on ternary composite Adsorption kinetics were well fitted by Pseudo-second order kinetic model (R2 = 0.99396). The thermodynamic parameters ΔH° = −0.0277 kJ.mol−1 and ΔS° = −60.9031 J mol−1.k−1 indicate endothermic and spontaneous adsorption process, (ΔG° > 0) non-spontaneous, and exothermic. Five adsorption/desorption cycles were demonstrated by the adsorbents’ high reusability.

Cubosome lipid nanocarriers for delivery of ultra-short antimicrobial peptides

HypothesisAlthough antimicrobial peptides (AMPs) are a promising class of new antibiotics, their inherent susceptibility to degradation requires nanocarrier-mediated delivery. While cubosome nanocarriers have been extensively studied for delivery of AMPs, we do not currently understand why cubosome encapsulation improves antimicrobial efficacy for some compounds but not others. This study therefore aims to investigate the link between the mechanism of action and permeation efficiency of the peptides, their encapsulation efficacy, and the antimicrobial activity of these systems. ExperimentsEncapsulation and delivery of Indolicidin, and its ultra-short derivative, Priscilicidin, were investigated using SAXS, cryo-TEM and circular dichroism. Molecular dynamics simulations were used to understand the loading of these peptides within cubosomes. The antimicrobial efficacy was assessed against gram-negative (E. coli) and gram-positive (MRSA) bacteria. FindingsA high ionic strength solution was required to facilitate high loading of the cationic AMPs, with bilayer encapsulation driven by tryptophan and Fmoc moieties. Cubosome encapsulation did not improve the antimicrobial efficacy of the AMPs consistent with their high permeation, as explained by a recent ’diffusion to capture model’. This suggests that cubosome encapsulation may not be an effective strategy for all antimicrobial compounds, paving the way for improved selection of nanocarriers for AMPs, and other antimicrobial compounds.

High ionic strength vector formulations enhance gene transfer to airway epithelia.

A fundamental challenge for cystic fibrosis (CF) gene therapy is ensuring sufficient transduction of airway epithelia to achieve therapeutic correction. Hypertonic saline (HTS) is frequently administered to people with CF to enhance mucus clearance. HTS transiently disrupts epithelial cell tight junctions, but its ability to improve gene transfer has not been investigated. Here, we asked if increasing the concentration of NaCl enhances the transduction efficiency of three gene therapy vectors: adenovirus, AAV, and lentiviral vectors. Vectors formulated with 3-7% NaCl exhibited markedly increased transduction for all three platforms, leading to anion channel correction in primary cultures of human CF epithelial cells and enhanced gene transfer in mouse and pig airways in vivo. The mechanism of transduction enhancement involved tonicity but not osmolarity or pH. Formulating vectors with a high ionic strength solution is a simple strategy to greatly enhance efficacy and immediately improve preclinical or clinical applications.

5-Fluoro uracil mediated transformation of surface-active ionic liquid based micellar nanoaggregates into pH-responsive vesicular nanoaggregates as promising drug delivery vehicle

Surface-active ionic liquids (SAILs) are poised as significant contenders in sustained and targeted drug delivery due to their membrane-like structures and their ability to transport drug molecules regardless of their polarity. In order to design a simple system that an encapsulate the anticancer drug and release it in a sustained manner, herein we designed vesicular nano-aggregates through synergistically interacting chemotherapeutic drug 5-Fluoro Uracil (5-FU) with the biocompatible SAILs, Choline Oleate ([Ch][Ol]) and Tetramethyl guanidine Oleate ([TMG][Ol]). The intention for designing the system is to offers less complexity and improved drug loading efficiency and targeted and sustained release. The molecular interactions have been proven by computational approach and the size of the nanoaggregates was determined using techniques such as Dynamic Light Scattering (DLS), Förster Resonance Energy Transfer (FRET) and Small-Angle Neutron Scattering (SANS). SANS fitting data and TEM images confirmed the transition of prolate ellipsoid micelles at [5-FU] = 0 mM to uni-lamellar ([5-FU] = 1 mM) and multi-lamellar vesicles ([5-FU] = 2 mM). These vesicular nano-aggregates are studied for their stability against temperature, pH-response and ionic strength of solution, revealing stability up to 60 °C, robust at physiological pH 7.4 and remain stable to exposure to Na+ and Ca2+ ions at concentrations up to 180 mM and 50 mM, respectively. The vesicular nano-aggregates ([Ch][Ol]/5-FU and [TMG][Ol]/5-FU) when exposed to physiological pH (i.e., 7.4) released 64.8 % and 61.2 % drug release whereas when the same systems were exposed to cancerous pH (5.2 and 6.7) released 95.9 % and 84.5% (pH 5.2 and 6.7) and 94.8 % and 81.2 % (pH 5.2 and 6.7) for the [Ch][Ol]/5-FU and [TMG][Ol]/5-FU systems, respectively. Results for the studied system encompasses them as a promising candidate for drug release at specific sites. The anticipated research might pave the way for the development of a biocompatible and stimuli-responsive drug carrier that would allow for the localized delivery of an anticancer drug.

Comparative study of polystyrene microplastic transport behavior in three different filter media: Quartz sand, zeolite, and anthracite

Microplastics (MPs) are emerging contaminants that are attracting increasing interest from researchers, and the safety of drinking water is greatly affected by their transportation during filtration. Polystyrene (PS) was selected as a representative MPs, and three filter media (quartz sand, zeolite, and anthracite) commonly found in water plants were used. The retention patterns of PS-MPs by various filter media under various background water quality conditions were methodically investigated with the aid of DLVO theory and colloidal filtration theory. The results show that the different structures and elemental compositions of the three filter media cause them to exhibit different surface roughnesses and surface potentials. A greater surface roughness of the filter media can provide more deposition sites for PS-MPs, and the greater surface roughness of zeolite and anthracite significantly enhances their ability to inhibit the migration of PS-MPs compared with that of quartz sand. However, surface roughness is not the only factor affecting the migration of MPs. The lower absolute value of the surface potential of anthracite causes the DLVO energy between it and PS-MPs to be significantly lower than that between zeolite and PS-MPs, which results in stronger retention of PS-MPs by anthracite, which has a lower surface roughness, than zeolite, which has a higher surface roughness. The transport of PS-MPs in the medium is affected by the combination of the surface roughness of the filter media and the DLVO energy. Under the same operating conditions, the retention efficiencies of the three filter materials for PS-MPs followed the order of quartz sand < zeolite < anthracite. Additionally, the conditions of the solution markedly influenced the transport ability of PS-MPs within the simulated filter column. The transport PS-MPs in the simulated filter column decreased with increasing solution ionic strength and cation valence. Naturally, dissolved organic matter promoted the transfer of PS-MPs in the filter layer, and humic acid had a much stronger facilitating impact than fulvic acid. The study findings might offer helpful insight for improving the ability of filter units ability to retain MPs.

Machine learning (ML): An emerging tool to access the production and application of biochar in the treatment of contaminated water and wastewater

To achieve sustainable development goals (SDGs), drinking water and/or wastewater treatment must be performed at a minimum cost along with negligible environmental impacts. Traditional approaches, like coagulation, precipitation, ion exchange, and membrane filtration have numerous drawbacks in terms of cost and effectiveness. Recently, the thermochemical conversion of biomasses/lignocellulosic wastes for biochar production and subsequently their application in the remediation of contaminated matrices is gaining attention. Further, the application of machine learning (ML) and artificial intelligence (AI) to optimize the production and application of biochar is a topical topic. Therefore, this review critically explains the optimised production process of biochar and its application in the removal of a diverse range of organic and inorganic contaminants from contaminated water and wastewater. Moreover, the review highlights the progress in organic and inorganic pollutants remediation with biochar, focusing on the significance and benefits of utilizing ML and AI to optimize adsorption variables and biochar feedstock properties. The surface area, porosity, and functional groups of the biochar, the type and quantity of the pollutants and the solution's pH, temperature, and ionic strength, all influence the adsorption capacity of the biochar. Furthermore, the duration of the biochar's interaction with the contaminants and the existence of competing ions are significant factors. Utilizing AI and ML proves to be efficient in terms of cost and time, enabling a multidisciplinary approach to eliminate pollutants using biochar. Finally, this review discusses the challenges associated with the application of ML and AI in the treatment of contaminated water and wastewater using biochar and proposed future prospects to make these technologies economically viable and sustainable.