Variation Of Molecular Weight Research Articles

Unravelling the Digestibility and Structure–Function Relationship of Lentil Protein Through Germination and Molecular Weight Fractionation

This study explores for the first time the impact of a 6-day germination process on the structure (FTIR), antioxidant activity, nutritional/safety attributes (ACE-I inhibitory activity, digestibility, and cytotoxicity), and functional properties of fractions of variable molecular weight (W > 5 kDa; 3 kDa < MW < 5 kDa; and MW < 3 kDa) isolated from proteins extracted from lentils. FTIR results indicated a substantial increase in β-sheet contents during germination. The digestibility of proteins increased from day 0 (16.32–17.04%) to day 6 of germination (24.92–26.05%) with variable levels of digestibility depending on their MW. ACE-I inhibitory activity improved during germination in all fractions, reaching IC50 values of 0.95, 0.83, and 0.69 mg/mL after 6 days of germination. All antioxidant activities analyzed notably increased, particularly in low-MW fractions (MW < 3 kDa). The functional properties of low-MW fractions were also the most promising, displaying the highest water and fat binding capacities and emulsifying and foaming capacities but lower foaming and emulsifying stability compared to high-MW fractions. Cytotoxicity tests on L929 cells revealed the slight adverse effects of low-MW fractions during germination. This study provides insights into the enhanced nutritional and functional attributes of lentil proteins following germination, emphasizing their potential application in functional foods.

Chitosan-polylactic acid composites: from seafood waste to advanced functional materials for 3D printing

The development of functional and sustainable materials for additive manufacturing is a rapidly expanding area of interest. In this context, composite blends of chitosan—including commercial low and medium molecular weight variants, as well as laboratory-extracted chitosan from shrimp head and shell waste—and polylactic acid (PLA) were prepared using extrusion molding. Filament characterization was conducted to explore the effects of chitosan molecular weight and content on the filament properties using melt flow index, tensile testing, dynamic mechanical analysis (DMA), and differential scanning calorimetry (DSC). The morphology of the extruded filaments was analyzed using scanning electron microscopy (SEM). Additionally, the possibility of incorporating a high ratio of metal into the composite filaments without compromising their printability and structural integrity was investigated. The results indicated that certain compositions of chitosan-PLA composite filaments enable the effective incorporation of nickel, highlighting their potential as innovative catalyst supports. The filaments were 3D printed in a molten state, and the resulting specimens were subsequently examined using micro-CT. This approach seeks to create an innovative material from food waste, offering a sustainable and circular solution for transforming seafood waste into advanced functional materials. The successful integration of shrimp waste-derived chitosan into PLA filaments not only enhances the material properties, but also demonstrates the potential for creating high-value products from bio-waste, contributing to environmental sustainability and advancing the field of eco-friendly additive manufacturing. This work highlights the promising application of composite filaments in various industrial sectors, emphasizing their role in promoting a circular economy.

Non-affinity platform for processing knob-into-hole bispecific antibody

Bispecific antibodies hold significant potential as next-generation biotherapeutics owing to their ability to simultaneously bind to two targets. However, the development of bispecific antibodies as biotherapeutics has been hindered by the high levels of byproducts produced, including both high molecular weight and low molecular weight variants. In addition, the inevitable expression of homodimers in host cells presents further obstacles to the commercial development of bispecific antibodies as therapeutics. These byproducts, which share similar physicochemical properties with the target, pose several challenges for downstream purification processes. In this study, we present a non-protein A purification platform that employ a one-step polishing chromatography to purify bispecific antibodies. Mixed-mode Capto adhere resin was used to capture the target protein at pH 7.90 ± 0.10, followed by anion exchange chromatography as a polishing step. Overall, the results of this two-step chromatography purification method demonstrated at final product purity of 98% as assessed by size-exclusion high-performance liquid chromatography (SEC-HPLC) and 98% by reversed-phase-high-performance liquid chromatography (RP-HPLC), with residual host cell proteins controlled at 10 ppm and an excellent recovery rate of approximately 60%. This study presents a non-protein A capture platform, offering a simplified, streamlined, and competitive alternative to conventional affinity chromatography.Graphical

Potentiality of Amaranthus viridis (L.) to accumulation of heavy metals and its relation to protein profile

The present study was undertaken to assess the levels of heavy metals (Cd, Fe, Ni and Zn) in soil and plant parts. The phytoremediation potential of Amaranthus viridis (amaranth) was determined by calculating the bioconcentration factor (BCF) and translocation factor (TF). Soil and plant samples were collected from eight different sites in their native habitats, distributed along Ismailia irrigation canal located in the east of the Nile Delta region, Egypt. Roots of amaranth had the higher concentrations of Cd, Fe and Ni means which were 2.75, 547.3 and 7.25 mg g-1 DW at sites SH8, SH6 and SH4 respectively, as compared to the other sampling sites. Whereas, shoots had the higher concentrations of Zn (283.6 mg g-1 DW) at site SH5. All sites were found with BCF more than 1 for all heavy metals. Except for Zn, TF values of Cd, Fe and Ni at all sites were lower than one. Depending on BCF and TF results, amaranth showed significant potential for phytostabilization of Cd, Fe and Ni and phytoextraction of Zn as well. Moreover, the protein profile showed different bands with varied molecular weights. Both relationships between studied accessions and similarity were elucidated, with high similarity (96% between SH2 and SH3 accessions), lowest similarity (72% between SH4 and SH8) and degree of polymorphism calculated as 62.5%. The variation in the similarity index may be due to the induction of a variety of proteins under heavy metal stress and also ecological features in various sites that cause protein polymorphism.

Transcriptome Analysis of Aureobasidium pullulans YQ65 Grown on Yeast Extract Peptone Glucose and Potato Dextrose Agar Media and Quantification of Their Effects on Pullulan Production.

Pullulan is a high-value polysaccharide produced through the fermentation of Aureobasidium pullulans. It has significant applications in the fields of food, medicine, environmental science, and packaging. However, the yield, molecular weight, and other characteristics of pullulan can vary depending on the fermentation substrate used. Therefore, it is crucial to analyze the underlying causes of these variations at the molecular level. In this study, we first investigated the morphological differences in A. pullulans YQ65 when cultured in YPD and PDA media. The results indicated that different culture media significantly influence the primary cell morphology of A. pullulans YQ65, which in turn affects the synthesis of secondary metabolites. Subsequently, we employed different culture media to ferment pullulan and examined the variations in pullulan yield, molecular weight, and biomass. Moreover, FTIR and thermodynamic stability tests were conducted to analyze the differences among pullulans across different culture media. Finally, transcriptome analysis revealed that A. pullulans YQ65, when cultured in YPD and PDA media, regulates its growth and metabolism through the expression of key genes that are involved in pathways such as the proteasome, oxidative phosphorylation, metabolism of various secondary metabolites, fatty acid anabolism, carbon metabolism, and amino acid metabolism. The transcriptome results were further validated by assessing the expression of specific genes. This study enhances the understanding of the fermentation differences observed with different substrates in A. pullulans and provides valuable insights for optimizing culture substrates. Additionally, it offers guidance for utilizing agricultural and forestry processing waste, as well as food processing by-products, to produce pullulan cost-effectively in the future.

DDDR-32. EXPLORING ANDROGENIC MODULATION IN GLIOBLASTOMA: POTENCY AND SELECTIVITY OF NOVEL NORETHINDRONE DERIVATIVES

Abstract BACKGROUND Glioblastoma (GBM) represents the most frequently diagnosed malignant CNS tumor in adults and remains incurable. Despite the identification of several oncogenic drivers contributing to tumor formation, targeted therapy with brain-penetrant inhibitors has afforded little progress in survival outcomes. Interestingly, gender has been shown to increase the incidence of GBM, with men having roughly a 50-60% increase in incidence compared to women in the US. This statistic led to research on the involvement of and subsequent inhibition of androgen synthesis and signaling in cell culture models and tumor samples. METHODS To further investigate the potential involvement of steroidal hormones in GBM proliferation, our lab synthesized a series of norethindrone (NE) derivatives with varied molecular weights, steric bulk, and lipophilicity to modulate the androgenic activity of NE. The small library was tested in several GBM cell lines, including U87, A172, and T98G cells, using cell viability assays. RESULTS One derivative, a lipophilically modified version of NE synthesized via a one-pot click reaction, was shown to have improved potency compared with parental NE (>5-fold). The lipophilic NE derivative had IC50 value of 22 uM, 15 uM, and 35 uM in the U87, A172, and T98G cells, respectively. This molecule was tested in immortalized normal human astrocyte (NHA) cells and found to have an IC50 value of 34 uM suggesting some selectivity. DISCUSSION Given this derivative’s activity in GBM models and modest selectivity, we plan to screen it in additional GBM cell lines (LN-18 and U251) and eventually in glioma stem cell models. Future research will focus on identifying key targets involved in the mechanism of action, including the impact of lipophilic addition to the steroid nucleus and its effect on androgenic activity and downstream signaling. We will investigate these effects using RPPA and co-treatments with androgen receptor antagonists and 5-alpha reductase inhibitors.

Comprehensive analysis of the oligopeptide transporter gene family in maize: Genome-wide identification, structural characterization, and stress-responsive expression

Oligopeptide transporter (OPT) proteins are integral proteins in cell membranes that perform a crucial role in cellular metal homeostasis, mineral uptake, transport of small peptides and abiotic stress tolerance. Hence, in-depth evolutionary, structural, molecular and expression analysis could guide in exploring the mechanism of how these transporters contribute to nutrient balance and abiotic stress tolerance in maize. Following a series of bioinformatic analyses, eight OPTs in maize were identified. These transporters showed significant variations in molecular weight, and have one to five introns, 11 to 15 motifs, 11 to 18 transmembrane domains, multiple beta-strands, multiple alpha and transmembrane helices. ZmOPT1, 5, and 6 are plasma membranes and the rest are endoplasmic reticulum localized. All ZmOPTs are distributed in six different chromosomes having significant phytohormone-responsive cis-elements might be due to their great roles in hormonal regulation in maize. The significant transport activity of these transporters plays a great role in biological processes, cellular components and molecular functions in maize during gene ontology analysis. Co-expression of five genes among eight OPTs with 56 genes might be due to their great role in regulating other genes in multiple signaling pathways or vice-versa. Significant tissue-specific and drought, salinity, nitrogen starvation, and heat stress induced in silico expression following real time PCR validation of ZmOPT1, 7, and 8 genes might guide to elucidate the potential roles of these transporters in specific tissues and abiotic stress tolerance. Hence, the findings of the research might guide plant biologists to develop new varieties of maize having higher efficiency of peptide and metal ion transport, balance, and abiotic stress tolerance. Findings of these structural and expression analyzes might guide the plant biologist for single transgenesis, or developing and transforming programming-based synthetic genetic circuits in maize for advancing research in peptide transport, metal hemostasis, and increasing abiotic stress tolerance in maize.

Effectual role of plant growth-promoting fungi and fosthiazate in controlling tomato root-knot nematode infection: In vivo and in vitro studies

Plant growth-promoting fungi (PGPF) are known to induce systemic resistance in plant diseases caused by microbial pathogens. However, the induced resistance by PGPF has not yet been elucidated in plant diseases caused by root-knot nematodes (RKNs, Meloidogyne spp.). Meloidogyne incognita can severely damage tomato plants, causing considerable losses in world yields. This study aimed to isolate and evaluate the potential of PGPF through enhancing systemic resistance, possibly through activating defense-related pathways in tomato plants, comparing to the commercial chemical nematicide, Melithorin® (fosthiazate 90 %). The most potent PGPF (K7, K13, K14) were identified morphologically and molecularly as Alternaria photistica, Penicillium buchwaldii, and Aspergillus niger, respectively. We tested the efficacy of these fungi against RKN (M. incognita) both in vitro and in vivo. The results demonstrated that the commercial nematicide fosthiazate (90 %) was the most effective treatment for controlling RKN J2 larvae, achieving a mortality rate of 94 % after 96 h. This was followed by the PGPF treatments, with A. niger at 92.6 %, P. buchwaldii at 87.7 %, Verticillium lecanii at 73.3 %, and A. photistica at 47.4 %. Additionally, applying A. photistica, A. niger, P. buchwaldii, and V. lecanii significantly enhanced the levels of photosynthetic pigments, total carbohydrates, and proteins in both healthy and RKN-infected plants. Notably, Melithorin® (fosthiazate 90 %), A. niger, and V. lecanii led to substantial increases in root carbohydrate content, with increases of 97 %, 63 %, and 58 %, respectively. Furthermore, Melithorin®, A. photistica, and A. niger significantly boosted shoot protein content by 68 %, 65 %, and 49 %, respectively, compared to the infected control group. These findings indicate that both nematicide and fungal treatments effectively reduce nematode populations and improve overall plant health and nutrient composition. At the same time, the results appeared that infected plants treated with PGPF or Melithorin® showed variation in number and molecular weight of protein bands. SDS-PAGE results indicated that, the highest number of bands (twelve) was recorded in the infected plants treated with Melithorin® followed by P. buchwaldii (11 bands), A. photistica (10 bands), V. lecanii (8 bands), and A. niger (7 bands), respectively. Also, the application of Melithorin®, A. niger, and V. lecanii resulted in a significant increase in the number and weight of fruits, respectively, compared to healthy control plants. Our results suggested that A. photistica, A. niger, P. buchwaldii, and V. lecanii could be used as effective and safe nematicides against RKNs.

Genome-wide characterization of nitric oxide-induced NBS-LRR genes from Arabidopsis thaliana and their association in monocots and dicots

BackgroundNitric oxide (NO) is pivotal in regulating the activity of NBS-LRR specific R genes, crucial components of the plant’s immune system. It is noteworthy that previous research has not included a genome-wide analysis of NO-responsive NBS-LRR genes in plants.ResultsThe current study examined 29 NO-induced NBS-LRR genes from Arabidopsis thaliana, along with two monocots (rice and maize) and two dicots (soybean and tomato) using genome-wide analysis tools. These NBS-LRR genes were subjected to comprehensive characterization, including analysis of their physio-chemical properties, phylogenetic relationships, domain and motif identification, exon/intron structures, cis-elements, protein-protein interactions, prediction of S-Nitrosylation sites, and comparison of transcriptomic and qRT-PCR data. Results showed the diverse distribution of NBS-LRR genes across chromosomes, and variations in amino acid number, exons/introns, molecular weight, and theoretical isoelectric point, and they were found in various cellular locations like the plasma membrane, cytoplasm, and nucleus. These genes predominantly harbor the NB-ARC superfamily, LRR, LRR_8, and TIR domains, as also confirmed by motif analysis. Additionally, they feature species-specific PLN00113 superfamily and RX-CC_like domain in dicots and monocots, respectively, both responsive to defense against pathogen attacks. The NO-induced NBS-LRR genes of Arabidopsis reveal the presence of cis-elements responsive to phytohormones, light, stress, and growth, suggesting a wide range of responses mediated by NO. Protein-protein interactions, coupled with the prediction of S-Nitrosylation sites, offer valuable insights into the regulatory role of NO at the protein level within each respective species.ConclusionThese above findings aimed to provide a thorough understanding of the impact of NO on NBS-LRR genes and their relationships with key plant species.

Storms and convection on Uranus and Neptune: Impact of methane abundance revealed by a 3D cloud-resolving model

Context. Uranus and Neptune have atmospheres dominated by molecular hydrogen and helium. In the upper troposphere (between 0.1 and 10 bar), methane is the third main molecule, and it condenses, yielding a vertical gradient in CH4 . As this condensable species is heavier than H2 and He, the resulting change in mean molecular weight due to condensation serves as a factor countering convection, which is traditionally considered as governed by temperature only. This change in mean molecular weight makes both dry and moist convection more difficult to start. As observations also show latitudinal variations in methane abundance, one can expect different vertical gradients from one latitude to another. Aims. In this paper, we investigate the impact of this vertical gradient of methane and the different shapes it can take, including on the atmospheric regimes and especially on the formation and inhibition of moist convective storms in the troposphere of ice giants. Methods. We developed a 3D cloud-resolving model to simulate convective processes at the required scale. This model is nonhydrostatic and includes the effect of the mean molecular weight variations associated with condensation. Results. Using our simulations, we conclude that typical velocities of dry convection in the deep atmosphere are rather low (on the order of 1 m/s) but sufficient to sustain upward methane transport and that moist convection at the methane condensation level is strongly inhibited. Previous studies derived an analytical criterion on the methane vapor amount above which moist convection should be inhibited in saturated environments. In ice giants, this criterion yields a critical methane abundance of 1.2% at 80 K (this corresponds approximately to the 1 bar level). We first validated this analytical criterion numerically. We then showed that this critical methane abundance governs the inhibition and formation of moist convective storms, and we conclude that the intensity and intermittency of these storms should depend on the methane abundance and saturation. In the regions where CH4 exceeds this critical abundance in the deep atmosphere (at the equator and the middle latitudes on Uranus and at all latitudes on Neptune), a stable layer almost entirely saturated with methane develops at the condensation level. In this layer, moist convection is inhibited, ensuring stability. Only weak moist convective events can occur above this layer, where methane abundance becomes lower than the critical value. The inhibition of moist convection prevents strong drying and maintains high relative humidity, which favors the frequency of these events. In the regions where CH4 remains below this critical abundance in the deep atmosphere (possibly at the poles on Uranus), there is no such layer. More powerful storms can form, but they are also a bit rarer. Conclusions. In ice giants, dry convection is weak, and moist convection is strongly inhibited. However, when enough methane is transported upward, through dry convection and turbulent diffusion, sporadic moist convective storms can form. These storms should be more frequent on Neptune than on Uranus because of Neptune’s internal heat flow and larger methane abundance. Our results can explain the observed sporadicity of clouds in ice giants and help guide future observations that can test the conclusions of this work.

One Reaction: Two Types of Mechanism-SARA-ATRP and SET-LRP-for MMA Polymerization in the Presence of PVC.

This study presents for the first time the polymerization of methyl methacrylate (MMA) in the presence of poly(vinyl chloride) (PVC) that takes place by both SARA-ATRP and SET-LRP mechanisms. The two types of polymerizations that occur in the system are PMMA grafting to the PVC backbone and the formation of a new PMMA polymer, both occurring in the presence of a Cu0wire. The polymerizations were controlled as confirmed by the molecular weight evolution, polymerization kinetics, and variations in the dispersity value. The MMA polymerization in the presence of PVC at 60 and 70 °C leads to the formation of two polymer species characterized by an increase in the molecular weight with the conversion and a narrowing of the dispersity value with the reaction progress. To increase the degree of control over the polymerization, the same reaction was performed at room temperature, which allowed us to highlight the presence of the SARA-ATRP and SET-LRP mechanisms via subsequent polymer chain extensions. The results demonstrated that PMMA grafting on PVC polymers follows a SARA-ATRP mechanism, while the formation of a PMMA homopolymer entails a SET-LRP process. The influence of solvent nature on the polymerization reaction was studied by performing the grafting of N-isopropylacrylamide (NIPAM) onto the surface of PVC particles in aqueous media in the presence and in the absence of CuCl2. The polymerization reactions and the obtained materials were studied by gel permeation chromatography (GPC), 1H NMR, DMA, scanning electron microscopy (SEM), and atomic force microscopy (AFM).

Mild Fabrication of Polymeric Porous/Nonporous Micro‐Composite Structures via Enhancing the Photothermal Conversion of Ultrafast Laser

AbstractLocalized foaming of polymers is promising to fabricate polymeric composite structures for applications in biomedical, aerospace, automotive, etc. However, the severe pyrolysis and carbonization of polymer chains during localized foaming may degrade the bulk strength. Herein, a mild localized foaming strategy is proposed to fabricate poly(lactic acid) (PLA) micro‐foams within dense PLA matrices using ultrafast lasers. The PLA substrates doped with graphene (Gr) and azodicarbonamide (AC) are developed for mild foaming. A picosecond laser is applied to pattern PLA micro‐foams on the PLA/Gr/AC substrates to fabricate porous/nonporous micro‐composite structures. The thermal behavior of the PLA/Gr/AC substrates is characterized to evaluate their capability in photothermal conversion and mild foaming during ultrafast laser pulses. To optimize the laser foaming process, the microstructure of the laser‐foamed PLA processed with different laser parameters is studied. It demonstrates that the oxidation of the functional groups dominates the side reactions on the PLA chains with slight variation in molecular weight during laser foaming, indicating that the PLA chains keep almost intact and mild localized foaming is realized. Furthermore, the developed technology is demonstrated for micro‐patterning and texturing, material toughness programming, and shape memory programming, showing promising applications for smart materials, metamaterials, micro‐robotics, and biological scaffolds.

Synthesis of linear low-density polyethylene waxes through chain-walking benzocycloalkyl nickel-catalyzed ethylene polymerization

Polyethylene wax is a highly useful material, and its diverse topological structures may have a significant impact on its applications. In this study, we have devised and synthesized a series of unilateral benzocycloalkyl α-diimine nickel catalysts. These nickel catalysts exhibited very high activities (1.06 to 10.25 × 106 g mol-1·h-1) and yielded branched (37–97/1000 C) polyethylene waxes with low molecular weights (Mn = 0.49 to 2.01 kg mol-1) and variable molecular weight distributions (1.79–35.05) in ethylene polymerization. Polymerization conditions such as pressure and temperature and catalyst structure such as backbone and axial substituents have an important influence on the polymerization activity and the properties of the resulting polyethylene waxes. High-temperature NMR reveals that these branched polyethylenes primarily feature short-chain branches, such as the methyl group, and exhibit a topology resembling that of low-molecular-weight linear low-density polyethylene (LLDPE).

The Influence of Molecular Weights on Dispersion and Thermoelectric Performance of Alkoxy Side-Chain Polythiophene/Carbon Nanotube Composite Materials.

In the development of wearable electronic devices, the composite modification of conductive polymers and single-walled carbon nanotubes (SWCNTs) has become a burgeoning research area. This study presents the synthesis of a novel polythiophene derivative, poly(3-alkoxythiophene) (P3(TEG)T), with alkoxy side chains. Different molecular weight variants of P3(TEG)T (P1-P4) were prepared and combined with SWCNTs to form composite materials. Density functional theory (DFT) calculations revealed a reduced bandgap for P3(TEG)T. Raman spectroscopy demonstrated π-π interactions between P3(TEG)T and SWCNTs, facilitating the dispersion of single-walled carbon nanotubes and the formation of a continuous conductive network. Among the composite films, P4/SWCNTs-0.9 exhibited the highest thermoelectric performance, with a power factor (PF) value of 449.50 μW m-1 K-2. The fabricated flexible thermoelectric device achieved an output power of 3976.92 nW at 50 K, with a tensile strength of 59.34 MPa for P4/SWCNTs. Our findings highlight the strong interfacial interactions between P3(TEG)T and SWCNTs in the composite material, providing an effective charge transfer pathway. Furthermore, an improvement in the tensile performance was observed with an increase in the molecular weight of the polymer used in the composite, offering a viable platform for the development of high-performance flexible organic thermoelectric materials.

Maillard conjugates of whey protein and prebiotic dietary fibers: Emulsion properties, encapsulation efficiency and chemical stability after in vitro gastrointestinal digestion

The incorporation of dietary fibers into food formulations is a promising approach to developing new functional ingredients. In this study, we investigated the formation of Maillard conjugates using whey protein concentrate (WPC) combined with fructooligosaccharides (FOS) and xylooligosaccharides (XOS). These conjugates, innovatively utilized as emulsifiers for annatto seed oil, were subjected to in vitro gastrointestinal digestion to assess their chemical stability and effectiveness as encapsulating systems. Our study confirmed the occurrence of the Maillard reaction through different methods, including grafting degree (GD) assessment and sodium dodecyl sulfate–polyacrylamide gel electrophoresis (SDS-PAGE) to evaluate molecular weight variations in the proteins. The key innovation of our research lies in demonstrating the conjugation process through carbohydrate mass balance analysis using High-Performance Anion Exchange Chromatography coupled with Pulsed Amperometric Detection (HPAEC-PAD). The GD for the WPC-XOS and WPC-FOS was 46 ± 3 % and 56 ± 3 %, respectively. Our findings suggest that sugar quantification could serve as a novel approach to confirming the formation of Maillard conjugates. The emulsions stabilized by these conjugates exhibited larger oil droplet sizes compared to those stabilized by WPC alone yet maintained high encapsulation efficiency (≥ 90 %). Notably, the WPC-XOS emulsion demonstrated kinetic stability after 30 days of storage at 4°C, while the WPC-FOS emulsion showed signs of creaming after just 16 days. In vitro gastrointestinal digestion revealed that while the conjugates were susceptible to enzymatic degradation, the FOS and XOS sugars displayed gastrointestinal resistance of up to 82 % and 83 %, respectively. This study highlights the potential of WPC-XOS conjugates not only as effective emulsifiers but also as functional ingredients that enhance the nutritional and antioxidant properties of food products, presenting a novel approach to functional food development.

Improving Efficiency of Organic Photovoltaics by Manipulating Critical Concentration of Polymer in Bulk‐Heterojunction Solution

AbstractIn the advancement of organic photovoltaics (OPV) toward scale‐up production, how to mitigate the batch instability of electron‐donating polymers originated from varied molecular weights remains a great challenge. By taking into consideration the relationship between the molecular weight of electron‐donating polymers and the relevant critical concentration (c*) of the solution, herein it is demonstrated that the aggregation behavior of the electron‐donating polymers can be tailored through manipulating c* of the polymer solution. It is interesting to note that the excessive aggregation in low‐molecular‐weight fractions can be circumvented while the favorable mixing ratio can be identified. By preparing the binary bulk heterojunction film under c*‐defined conditions for mixed‐molecular‐weight polymers, a notable power conversion efficiency of 19.1% for binary devices is achieved. Of particular importance is that a linear interrelation can be established between the c* for the maximum PCE and c* for the low‐molecular‐weight fraction aggregation, validating those straightforward spectra measurements can accurately and rationally guide the molecular weight mixing of photovoltaic donor polymers, thereby fully harnessing the potent driving force and affinity inherent to the low‐molecular‐weight fractions. These findings offer a straightforward and logical framework for addressing batch variability in the large‐scale production of high‐performance OPV devices.

Synthesis of new pyrazine-pyrazole-thiazolidin-4-one and pyrazine-triazole-thiazolidin-4-one conjugates, molecular modelling and docking as antimicrobial agents

The ever-increasing incidence of microbial resistance provide a significant peril to the scientific community. Thus, the need for the discovery and development of new antimicrobial agents is becoming critical. An effective approach to address this challenging problem is to generate hybrid molecules by combining two or more pharmacophores covalently linked to a single-molecule platform. Antimicrobial hybrids have been proposed as promising solution to overcome drug resistance and/or presumably having a broader spectrum of activity. This guided us to synthesize a new series of eight final target pyrazine-pyrazole-thiazolidin-4-one and pyrazine-triazole-thiazolidin-4-one hybrids 7, 8a-c, 12, and 13a-c and investigate their biological activities. Characterization of the designed hybrids were performed using IR, 1H NMR, 13C NMR, and mass analyses. The DFT/B3LYP approach revealed that the synthesized hybrids had a non-planar configuration. The nitrobenzylidene derivatives 8c and 13c exhibited the highest polarizability and hyperpolarizability. We examined the antimicrobial activity, DNA gyrase inhibition, molecular docking, and Swiss ADME analysis of different pyrazine-pyrazole-thiazolidin-4-one and pyrazine-triazole-thiazolidin-4-one conjugates. These compounds are effective against a number of bacterial and fungal strains, suggesting possible treatments for certain infections. DNA gyrase inhibition experiments demonstrated that conjugate 13b was more effective than novobiocin. A molecular docking study sheds light on the binding affinities and interactions of these conjugates with target proteins, revealing strong and specific bindings for numerous conjugates. Swiss ADME studies examine important pharmacokinetic parameters and show issues with bioavailability and membrane permeability in the mouth because of variations in molecular weight, lipophilicity, and hydrogen bond interactions. Swiss ADME studies have studied the drug-like qualities of these conjugates, revealing their potential in antibacterial applications.

Permselectivity of Silk Fibroin Hydrogels for Advanced Drug Delivery Neurotherapies.

A promising trend in tissue engineering is using biomaterials to improve the control of drug concentration in targeted tissue. These vehicular systems are of specific interest when the required treatment time window is higher than the stability of therapeutic molecules in the body. Herein, the capacity of silk fibroin hydrogels to release different molecules and drugs in a sustained manner was evaluated. We found that a biomaterial format, obtained by an entirely aqueous-based process, could release molecules of variable molecular weight and charge with a preferential delivery of negatively charged molecules. Although the theoretical modeling suggested that drug delivery was more likely to be driven by Fickian diffusion, the external media had a considerable influence on the release, with lipophilic organic solvents such as acetonitrile-methanol (ACN-MeOH) intensifying the release of hydrophobic molecules. Second, we found that silk fibroin could be used as a vehicular system to treat a variety of brain disorders as this biomaterial sustained the release of different factors with neurotrophic (brain-derived neurotrophic factor) (BDNF), chemoattractant (C-X-C motif chemokine 12) (CXCL12), anti-inflammatory (TGF-β-1), and angiogenic (VEGF) capacities. Finally, we demonstrated that this biomaterial hydrogel could release cholesteronitrone ISQ201, a nitrone with antioxidant capacity, showing neuroprotective activity in an in vitro model of ischemia-reoxygenation. Given the slow degradation rate shown by silk fibroin in many biological tissues, including the nervous system, our study expands the restricted list of drug delivery-based biomaterial systems with therapeutic capacity for both short- and especially long-term treatment windows and has merit for use with brain pathologies.

Production and molecular weight variation of poly-γ-glutamic acid using a recombinant Bacillus subtilis with various pgs-component ratios.

Poly-γ-glutamic acid (PGA) has been of interest as a sustainable biopolymer in industrial applications. PGA biosynthesis in Bacillus subtilis is catalyzed by a transmembrane protein complex comprising PgsB, PgsC, and PgsA. To determine the Pgs component responsible for PGA overproduction, we constructed recombinants in which the promoter of the host-derived pgs gene was replaced with another host-derived gene promoter. These recombinants were then transformed using high-copy-number plasmids with various pgs-gene combinations to enhance Pgs component in different ratios. Subsequently, PGA production was investigated in batch cultures with l-glutamate supplemented medium. The recombinant strain enhanced with pgsB alone significantly overproduced PGA (maximum production 35.8 gL-1) than either the pgsC- or pgsA-enhanced strain. The molecular weight of the PGA produced with pgsB-enhanced strain was also greater than the pgsC- or pgsA-enhanced strain (approximately 10-fold). Hence, PgsB enhancement alone contributes to PGA overproduction with increased molecular weight.

Unravelling structure evolution of dissolved organic matter during oxidation by persulfate: Insights from aromaticity and fluorescence analysis

Persulfate advanced oxidation technology is widely utilized for remediating organic-contaminated groundwater. Post-remediation by persulfate oxidation, the aromaticity of dissolved organic matter (DOM) in groundwater is significantly reduced. Nevertheless, the evolution trends of aromaticity and related structural changes in DOM remained unclear. Here, we selected eight types of DOM to analyze the variation in aromaticity, molecular weight, and fluorescence characteristics during oxidation by persulfate using optical spectroscopy and parallel faction analysis combined with two-dimensional correlation spectroscopy analysis (2D PARAFAC COS). The results showed diverse trends in the changes of aromaticity and maximum fluorescence intensity (Fmax) among different types of DOM as the reaction time increases. Four types of DOM (humic acid 1S104H, fulvic acid, and natural organic matters) exhibited an initially noteworthy increase in aromaticity followed by a decrease, while others demonstrated a continuous decreasing trend (14.3%–69.4%). The overall decreasing magnitude of DOM aromaticity follows the order of natural organic matters ≈ commercial humic acid > fulvic acid > extracted humic acid. The Fmax of humic acid increased, exception of commercial humic acid. The Fmax of fulvic acid initially decreased and then increased, while that of natural organic matters exhibited a decreasing trend (86.4%). The fulvic acid-like substance is the main controlling factor for the aromaticity and molecular weight of DOM during persulfate oxidation process. The oxidation sequence of fluorophores in DOM is as follows: fulvic-like substance, microbial-derived humic-like substance, humic-like substance, and aquatic humic-like substance. The fulvic-like and microbial-derived humic-like substances at longer excitation wavelengths were more sensitive to the response of persulfate oxidation than that of shorter excitation wavelengths. This result reveals the structure evolution of DOM during persulfate oxidation process and provides further support for predicting its environmental behavior.