Effects of root-zone warming, nitrogen supply and their interactions on root-shoot growth, nitrogen uptake and photosynthetic physiological characteristics of maize.

In the context of climate change, the impact of root-zone warming (RW) on crop nutrient absorption and utilization has emerged as a significant concern that cannot be overlooked. Nitrogen (N) is an essential element for crop growth and development, particularly under stress. The comprehensive effect and relationship between RW and N level remains unclear. The objective of this experiment was to investigate the impact of RW on root-shoot growth and photosynthetic physiological characteristics of maize seedlings under varying N levels. The results demonstrated that optimal RW was beneficial to the growth of maize, while excessive root-zone temperature (RT) significantly impeded N uptake in maize. Under low N treatment, the proportion of N distribution in roots increased, and the root surface area increased by 41 %. Furthermore, under low N levels, the decline in root vitality and the increase in root MDA caused by high RT were mitigated, resulting in an enhancement of the root's ability to cope with stress. For the above-ground part, under the double stress of high RT and low N, the shoot N concentration, leaf nitrate reductase, leaf glutamine synthase, chlorophyll content, net photosynthetic rate and shoot dry matter accumulation decreased by 86 %, 60 %, 35 %, 53 %, 64 % and 59 %, respectively. It can be reasonably concluded that reasonable N management is an important method to effectively reduce the impact of high RT stress.

Henna plant biomass enhanced azo dye removal: Operating performance, microbial community and machine learning modeling.

The bio-reduction of azo dyes is significantly dependent on the availability of electron donors and external redox mediators. In this study, the natural henna plant biomass was supplemented to promote the biological reduction of an azo dye of Acid Orange 7 (AO7). Besides, the machine learning (ML) approach was applied to decipher the intricate process of henna-assisted azo dye removal. The experimental results indicated that the hydrolysis and fermentation of henna plant biomass provided both electron donors such as volatile fatty acid (VFA) and redox mediator of lawsone to drive the bio-reduction of AO7 to sulfanilic acid (SA). The high henna dosage selectively enriched certain bacteria, such as Firmicutes phylum, Levilinea and Paludibacter genera, functioning in both the henna fermentation and AO7 reduction processes simultaneously. Among the three tested ML algorithms, eXtreme Gradient Boosting (XGBoost) presented exceptional accuracy and generalization ability in predicting the effluent AO7 concentrations with pH, oxidation-reduction potential (ORP), soluble chemical oxygen demand (SCOD), VFA, lawsone, henna dosage, and cumulative henna as input variables. The validating experiments with tailored optimal operating conditions and henna dosage (pH 7.5, henna dosage of 2 g/L, and cumulative henna of 14 g/L) confirmed that XGBoost was an effective ML model to predict the efficient AO7 removal (91.6%), with a negligible calculating error of 3.95%. Overall, henna plant biomass addition was a cost-effective and robust method to improve the bio-reduction of AO7, which had been demonstrated by long-term operation, ML modeling, and experimental validation.

Structural and functional investigation on stem and peel polysaccharides from different varieties of pitaya.

Varieties of plant species may affect the composition and structures of the polysaccharides, thus have an impact on their chemical properties and biological activities. Herein, the present study comparatively evaluated the differences in the chemical composition, morphological structures, antioxidant activity, and anti-inflammatory activity of the stem and peel polysaccharides from different varieties of pitaya. The FT-IR and NMR spectra indicated that the six polysaccharides had similar structural features, whereas the physicochemical characterization showed that they differed significantly in terms of the monosaccharide composition, molecular weight, and surface morphology. In addition, different varieties of pitaya polysaccharides exhibited different antioxidant activities and similar anti-inflammatory activities. These data suggested that varietal differences resulted in pitaya stem and peel polysaccharides with different monosaccharide compositions and molecular weights, thus led to different antioxidant activities and protection against oxidative damage, while similar structural features were closely related to their similar anti-inflammatory activities. Therefore, the study of the stem and peel polysaccharides from different varieties of pitaya can help us to better understand the relationship between their composition and structure and their biological activities. In addition, pitaya stem and peel polysaccharides have the potential to act as antioxidants or to treat inflammatory damage.

Molecular simulations required to target novel and potent inhibitors of cancer invasion.

INTRODUCTION: Computer-aided drug design (CADD) is a computational approach used to discover, develop, and analyze drugs and active molecules with similar biochemical properties. Molecular simulation technology has significantly accelerated drug research and reduced manufacturing costs. It is an optimized drug discovery method that greatly improves the efficiency of novel drug development processes. AREASCOVERED: This review discusses the development of molecular simulations of effective cancer inhibitors and traces the main outcomes of in silico studies by introducing representative categories of six important anticancer targets. The authors provide views on this topic from the perspective of both medicinal chemistry and artificial intelligence, indicating the major challenges and predicting trends. EXPERT OPINION: The goal of introducing CADD into cancer treatment is to realize a highly efficient, accurate, and desired approach with a high success rate for identifying potent drug candidates. However, the major challenge is the lack of a sophisticated data-filtering mechanism to verify bottom data from mixed-quality references. Consequently, despite the continuous development of algorithms, computer power, and interface optimization, specific data filtering mechanisms will become an urgent and crucial issue in the future.

Stormwater runoff pollution control performance of permeable concrete pavement and constructed wetland combined system: toward on-site reuse.

Urban waterlogging and the deterioration of receiving water quality caused by stormwater runoff have become increasingly significant problems. Based on the concept of combining grey and green infrastructure, a combined permeable concrete pavement (PCP) and constructed wetland (CW) system has been developed to treat stormwater runoff and enable on-site reuse. The results showed that the removal rate of suspended solids (SS) by PCP ranged from 96.61 to 99.20%; however, the chemical oxygen demand (COD), total nitrogen (TN), and total phosphorus (TP) concentrations in the effluent did not meet the standards required for rainwater reuse. For the combined PCP-CW system, the removal rates of COD, TN and TP by the CW were 48.45-75.12%, 47.26-53.05%, and 59.04-75.28%, respectively, under different hydraulic loading (HL) rates; thus, the effluent TN concentrations did not consistently meet the reuse standards. Further optimization of aeration in different parts of the CW revealed that aeration in the middle and front sections of the wetland had the most significant effect on pollutant removal, under which the TN concentrations in the effluent met the standard required for reuse. The effluent from the combined PCP-CW system was able to fully meet the stormwater reuse standards under these optimized conditions, and the reuse of urban stormwater runoff can therefore be realized.

Root zone temperature regulates potassium absorption and photosynthesis in maize (Zea mays).

Affected by climate warming, the impact of crop root zone warming (RZW) on maize seedling growth and nutrient uptake deserve attention. The characteristics of K uptake in maize under root zone warming and the combined impacts of potassium deficiency and RZW are still unclear. The present study aimed to investigate the effects of RZW on potassium absorption and photosynthesis of maize seedlings under the difference in potassium. The results showed that RZW and low potassium treatment significantly affected root shoot development and photosynthetic physiological characteristics of maize seedlings. Moreover, the interaction of RZW and potassium content had striking influence on maize seedlings. Under the normal potassium with root zone medium temperature treatment, the development of maize was the most vigorous. Under the dual stress of high root zone temperature and low potassium, the root absorption area, total potassium content and root activity were significantly reduced, which then influenced the light energy use efficiency and dry matter accumulation. Securing the supply of potassium fertilizer under high root zone temperature stress is useful to alleviate the impact of high temperature stress.

Chronic stress boosts systemic inflammation and compromises antiviral innate immunity in Carassius gibel.

It is generally considered that stress causes decreased immune function and render fish vulnerable to infection and diseases. However, the molecular mechanisms between stress responses and susceptibility to infections, especially viral diseases, in fish remain unknown. Understanding and monitoring the biological consequences and mechanisms underlying stress responses in fish may contribute to the improvement of animal welfare and production efficiency. In this study, long-term exposure to a variety of stressors, including chasing, overcrowding, restraint stress, and air exposure mimicking chronic stresses, in aquaculture practices was conducted in Carassius gibel to investigate the consequences of chronic stress on inflammation and antiviral capability. With the continuation of stimulation, experimental fish gradually became insensitive to the stress of net chasing and feeding with the accompaniment of upregulated gene expressed in the HPI axis and elevated levels of stress hormones. As expected, stress-induced hyperglycaemia with a decrease in the insulin signaling pathway and altered gene expression in glycolysis and gluconeogenesis, suggesting the disturbance of glycometabolism. Importantly, a link between intestinal homoeostasis and systemic low-grade inflammation in stressed C. gibel was observed, implying crosstalk among the brain, intestine, and other organs. Furthermore, the compromised antiviral capability with impaired antiviral innate immunity in stressed fish was confirmed by RNA sequencing and infection with Cyprinid herpesvirus 2 (CyHV-2), promoting the understanding of enhanced susceptibility to viral infection in stressed fish.

Negative effects of soil warming, and adaptive cultivation strategies of maize: A review.

Temperature is a key factor in regulating and controlling several ecological processes. As there is a feedback relationship between many biogeochemical processes and climate change, their response to temperature changes is particularly important. Previously, a large volume of literature has extensively explored the impact of rising air temperature on shoot growth and maize yield, from enzymatic responses within the leaf to grain yield. As the global temperature continues to increase and the frequency, duration, and/or intensity of heat wave events increases, the soil temperature of the tilth is likely to rise sharply. As one of the most widely planted food crops in the world, maize may be subjected to additional soil temperature pressure. However, as a nutrient organ in direct contact with soil, the root plays a key role in adapting the whole plant to excessive soil temperature. Little research has been done on the effect of the soil microenvironment induced by higher soil temperature on maize root growth and root to shoot communication regulation. Therefore, this review summarizes (1) the effects of excessive soil temperature on the soil microenvironment, including soil respiration, microbial community composition, carbon mineralization, and enzyme activity; (2) the negative response of absorption of water and nutrients by roots and maize root-shoot growth to excessive soil temperature; and (3) potential cultivation strategies to improve maize yield, including improving tillage methods, adding biochar amendments, applying organic fertilizers, optimizing irrigation, and farmland mulching.

Discovery of pyrazole-carbohydrazide with indole moiety as tubulin polymerization inhibitors and anti-tumor candidates.

In this work, a series of indole-containing pyrazole-carbohydrazide derivatives A1-A25 were synthesized, and their biological activity on tubulin polymerization inhibition and mitotic catastrophe was evaluated. For introducing indole group to CA-4 pattern, the carbohydrazide linker was used for the first time. As the top hit, A18 suggested notable antiproliferation efficacy and tubulin polymerization inhibitory activity. Inferring comparable antitubulin effect with the positive control Colchicine, A18 indicated obviously lower cyto-toxicity. The cell scratch test showed that A18 could block the cell migration, while the confocal imaging depicted that A18 could induce the mitotic catastrophe via a Colchicine-like approach. The docking simulation visualized the probable binding pattern of A18. With the information in this work, some new hints on modification might be involved in further tubulin-related investigations.

Investigation of putative antimicrobial peptides in Carassius gibel, revealing a practical approach to screening antimicrobials.

Antimicrobial peptides (AMPs) and their mimics are rapidly gaining attention as a new class of antimicrobials due to their clinical potential. AMPs are widely distributed throughout nature and participate in the innate host defense. In this study, 18 AMPs, including 3 ß-defensins, 3 hepcidins, 4 liver-expressed antimicrobial peptide 2 (LEAP-2) compounds, 4 g-type lysozymes, 2 c-type lysozymes, and 2 NK-lysins, were identified from the genome of Carassius auratus by a homologous search and were further classified based on their fundamental structural features and molecular phylogeny. C. auratus AMPs were found to be ubiquitously distributed in all tested tissues and showed similar expression profiles, with the exception of ß-defensins, when RT-qPCR was used to investigate the tissue distribution of AMPs in healthy Carassius gibel. In addition, the expression levels of NK-lysin genes in the tested tissues tended to be upregulated upon bacterial and viral infection when representative NK-lysins were chosen to examine their relative expression levels in various tissues. Importantly, the synthetic peptide caNKL2102-119, which targets the functional domain of saposin B in caNK-lysins, could effectively counter Aeromonas hydrophila, Staphylococcus aureus, and Escherichia coli with minimum inhibitory concentration (MIC) values of 3-6 µg/mL, as well as inhibit the proliferation of spring viraemia of carp virus (SVCV). These results provide potential targets for antibiotic-free breeding in the aquaculture industry.

A Novel Fluorescent Probe for Selective Detection of Hydrazine and Its Application in Imaging.

In this work, a novel fluorescent probe with first-time-selected thiazepine backbone, TZPzine-1, was developed for selective detection of hydrazine in water samples and living cells. Chosen from our recent anti-cancer agents, TZPzine-1 inferred structurally based advantages of the optical adjustability and the hydrazine-trapping approach. It also showed applicable properties including high sensitivity (LOD = 50 nM), wide linear range (0-15 equiv.), high selectivity (especially from competing species), rapid response (within 20 min), and practical steadiness in various pH (6.0-11.0) and temperature (15-50 °C) conditions. To satisfy the interdisciplinary requirements in environmental toxicology, TZPzine-1 was successfully applied in water samples and living cells. We hope that the information in this work, as well as the concept of monitoring the nitrogen cycle, may be referable for future research on systematic management.

Discovery of novel indole-1,2,4-triazole derivatives as tubulin polymerization inhibitors.

A series of novel indole-1,2,4-triazole derivatives have been designed, synthesized, and evaluated as potential tubulin polymerization inhibitors. The top hit 12, bearing the 3,4,5-trimethoxyphenyl moiety, exhibited substantial anti-proliferative activity against HepG2, HeLa, MCF-7, and A549 cells in vitro with IC50 values of 0.23 ± 0.08 µM, 0.15 ± 0.18 µM, 0.38 ± 0.12 µM, and 0.30 ± 0.13 µM, respectively. It also inhibited tubulin polymerization with the IC50 value of 2.1 ± 0.12 µM, which was comparable with that of the positive controls. Furthermore, compound 12 regulated the expression of cell cycle-related proteins (Cyclin B1, Cdc25c, and Cdc2) and apoptosis-related proteins (Bcl-2, Bcl-x, and Mcl-1). Mechanistically, compound 12 could arrest cell cycle at the G2/M phase, thus induce an increase of apoptotic cell death. In addition, molecular docking hinted the possible interaction mode of compound 12 into the colchicine binding site of tubulin heterodimers. According to the applications of microtubule-targeting agents in both direct and synergistic cancer therapies, we hope this work might be of significance for future researches.

Valorizing kitchen waste through bacterial cellulose production towards a more sustainable biorefinery.

In this work, water washing pretreatment was employed on kitchen waste (KW) to integrate a multi-product biorefinery process for producing biogas, biodiesel, bacterial cellulose (BC) and biofertilizer. As a crucial stream in this biorefinery process, BC production were investigated to clarify the effects of residual salt and cooked oil. Meanwhile, glycerol, a by-product in biodiesel stream, as carbon source was attempted to produce BC. Results indicated that BC yield was significantly promoted from 0.11 g L-1 to 2.07 g L-1 as NaCl content decreased from 0.44% to 0.04%. Correspondingly, the BC crystallinity increased from 30.1% to 57.4% and the tensile strength increased from 3.30 MPa to 21.64 MPa. In addition, the residual cooked oil didn't affect the BC yield significantly, however, the crystallinity was greatly decreased from 57.4% to 34.5% as more cooked oil was remained in the medium of KW, and the tensile strength was decreased from 21.64 MPa to 4.30 MPa, correspondingly. Obviously, reducing the salt and cooked oil content in the starch fraction of KW by intensifying the water washing pretreatment will greatly benefit the BC yield and qualities. When the glycerol from biodiesel stream was employed for BC production with content of 10 g L-1-25 g L-1, 34.2%-44.0% increase on BC yield can be achieved. By contrast, extra higher glycerol content (50 g L-1) reduced the BC yield by 41%. However, the crystallinity and the tensile strength were increased by 18% and 2.2-folds, respectively. Therefore, the biodiesel stream can be well integrated in the process via producing BC with by-product of glycerol as a replaceable carbon source. Based on the results above, a more sustainable biorefinery process of KW via BC production can be achieved, which will potentially offer a new path to valorize the daily-released KW.

Hierarchical Two-Dimensional Conductive Metal-Organic Framework/Layered Double Hydroxide Nanoarray for a High-Performance Supercapacitor.

A novel hierarchical nanoarray material based on a two-dimensional metal-organic framework (Ni-CAT) and a layered double hydroxide (NiCo-LDH) was fabricated on a nickel foam substrate. By taking advantage of the regular nanostructure and making full use of the high porosity and excellent conductivity, the hybrid material exhibits a high areal capacitance for a supercapacitor (3200 mF cm-2 at 1 mA cm-2).

Formation of bimetallic metal-organic framework nanosheets and their derived porous nickel-cobalt sulfides for supercapacitors.

Metal-organic frameworks (MOFs) show great advantages as new kinds of active materials for energy storage. In this study, bimetallic metal-organic frameworks (Ni/Co-MOFs) with nanosheet-assembled flower-like structures were synthesized by etching Ni-MOF microspheres in a cobalt nitrate solution. It can be clearly observed that the amount of Co(NO3)2 and etching time play crucial roles in the formation of Ni/Co-MOF nanosheets. The Ni/Co-MOFs were used as electrode materials for supercapacitors and the optimized Ni/Co-MOF-5 exhibited the highest capacitances of 1220.2 F g-1 and 986.7 F g-1 at current densities of 1 A g-1 and 10 A g-1, respectively. Ni/Co-MOF-5 was further sulfurized, and the derived Ni-Co-S electrode showed a higher specific capacitance of 1377.5 F g-1 at a current density of 1 A g-1 and a retention of 89.4% when the current density was increased to 10 A g-1, indicating superior rate capability. Furthermore, Ni/Co-MOF-5 and Ni-Co-S showed excellent cycling stability, i.e. about 87.8% and 93.7% of initial capacitance can be still maintained after 3000 cycles of charge-discharge. More interestingly, the Ni/Co-MOF-5//AC ASC shows an energy density of 30.9 W h kg-1 at a power density of 1132.8 W kg-1, and the Ni-Co-S//AC ASC displays a high energy density of 36.9 W h kg-1 at a power density of 1066.42 W kg-1. These results demonstrate that the as-synthesized bimetallic Ni/Co-MOF nanosheets and their derived nickel-cobalt sulfides have promising applications in electrochemical supercapacitors.

High-performance supercapacitors of Cu-based porous coordination polymer nanowires and the derived porous CuO nanotubes.

Electrode materials for supercapacitors with one-dimensional porous nanostructures, such as nanowires and nanotubes, are very attractive for high-efficiency storage of electrochemical energy. Herein, ultralong Cu-based porous coordination polymer nanowires (copper-l-aspartic acid) were used as the electrode material for supercapacitors, for the first time. The as-prepared material exhibits a high specific capacitance of 367 F g-1 at 0.6 A g-1 and excellent cycling stability (94% retention over 1000 cycles). Moreover, porous CuO nanotubes were successfully fabricated by the thermal decomposition of this nanowire precursor. The CuO nanotube exhibits good electrochemical performance with high rate capacity (77% retention at 12.5 A g-1) and long-term stability (96% retention over 1000 cycles). The strategy developed here for the synthesis of porous nanowires and nanotubes can be extended to the construction of other electrode materials for more efficient energy storage.

Hierarchical core-shell SiO2@PDA@BiOBr microspheres with enhanced visible-light-driven photocatalytic performance.

To explore catalysts combining highly accessible specific surface areas with low recombination of the photo-induced electron-hole pairs, a novel SiO2@PDA@BiOBr composite photocatalyst with a hierarchical core-shell structure was prepared by a facile solvothermal method. The catalyst shows a superior performance on photodegradation of Rhodamine B under visible light irradiation, especially for SiO2@PDA-2@BiOBr with the reactant kinetics constant (k = 0.0487 min-1). The enhanced photocatalytic performance of SiO2@PDA-2@BiOBr was ascribed to the decreased band-gap, higher surface area, and effectively photo-generated electron-hole pairs by the introduction of polydopamine (PDA). In addition, the photocatalytic degradation is initiated by ˙O2- derived from dye photosensitization and h+ from the BiOBr. Cyclic experiments also indicate that the SiO2@PDA-2@BiOBr is reusable during the photodegradation process. The hierarchical core-shell SiO2@PDA@BiOBr photocatalyst will provide a theoretical model for the development of physical chemistry and structural properties of BiOBr-based composites to enhance the photocatalytic performances.

A hierarchical NiO/NiMn-layered double hydroxide nanosheet array on Ni foam for high performance supercapacitors.

A hierarchical NiO/NiMn-LDH nanosheet array on Ni foam was prepared via a facile two-step approach and exhibited a high specific capacitance (937 F g-1 at 0.5 A g-1) and good cycling stability (91% retention after 1000 cycles at 5 A g-1). The improved electrochemical performance is benefited from the synergistic properties of hierarchical NiO/LDH nanosheet composites on a conductive substrate.

Enhanced photocatalytic performance of BiOBr/NH2-MIL-125(Ti) composite for dye degradation under visible light.

Metal-organic frameworks (MOFs) are considered as suitable materials for various applications in the area of photocatalysis. On the other hand, 2D BiOBr materials are efficient for the photodegradation of organic dyes under visible light illumination. In this work, BiOBr/NH2-MIL-125(Ti) composite photocatalysts with different NH2-MIL-125(Ti) content were prepared by incorporating NH2-MIL-125(Ti) with BiOBr using a co-precipitation method. A series of characterizations confirmed the strong synergistic effect between BiOBr and NH2-MIL-125(Ti). In rhodamine B (RhB) degradation experiments, the composite photocatalyst with a mass percent of 7 wt% NH2-MIL-125(Ti) exhibited an improved photocatalytic activity compared to pristine BiOBr and NH2-MIL-125(Ti). Furthermore, the enhanced photocatalytic performance under visible light illumination could be attributed to the Ti3+-Ti4+ intervalence electron transfer and synergistic effect between NH2-MIL-125(Ti) and BiOBr, and also resulted in a separation efficiency of photo-generated electron-hole pairs during the photocatalytic reaction. This study can open up numerous opportunities for the development of various MOF-based visible light photocatalysts when combined with 2D bismuth oxyhalide materials for applications in environmental cleaning.