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Functional group diversity for the adsorption of lead(Pb) to bacterial cells and extracellular polymeric substances
2022
Qu, Chenchen | Yang, Shanshan | Mortimer, Monika | Zhang, Ming | Chen, Jinzhao | Wu, Yichao | Chen, Wenli | Cai, Peng | Huang, Qiaoyun
Bacteria and their secreted extracellular polymeric substances (EPS) are widely distributed in ecosystems and have high capacity for heavy metal immobilization. The knowledge about the molecular-level interactions with heavy metal ions is essential for predicting the behavior of heavy metals in natural and engineering systems. This comprehensive study using potentiometric titration, Fourier-transform infrared (FTIR) spectroscopy, isothermal titration calorimetry (ITC) and X-ray absorption fine structure (XAFS) was able to reveal the functional diversity and adsorption mechanisms for Pb onto bacteira and the EPS in greater detail than ever before. We identified mono-carboxylic, multi-carboxylic, phosphodiester, phosphonic and sulfhydryl sites and found the partitioning of Pb to these functional groups varied between gram-negative and gram-positive bacterial strains, the soluble and cell-bound EPS and Pb concentrations. The sulfhydryl and phosphodiester groups preferentially complexed with Pb in P. putida cells, while multifunctional carboxylic groups promoted Pb adsorption in B. subtilis cells and the protein fractions in EPS. Though the functional site diversity, the adsorption of Pb to organic ligands occurred spontaneously through a universal entropy increase and inner-sphere complexation mechanism. The functional group scale knowledge have implications for the modeling of heavy metal behavior in the environment and application of these biological resources.
Показать больше [+] Меньше [-]A hybrid air pollutant concentration prediction model combining secondary decomposition and sequence reconstruction
2020
Sun, Wei | Huang, Chenchen
Acid rain is a serious threat to terrestrial ecosystems. To provide more accurate early warning information for acid rain prevention, urban planning, and travel planning, a novel air pollutant prediction model was proposed in this paper to predict NO₂ and SO₂. First, the data were decomposed into several sub-sequences by a complete ensemble empirical mode decomposition with adaptive noise. Second, the subsequences are reconstructed by variational mode decomposition and sample entropy. Then, the new subsequences are predicted by the extreme learning machine combined with the whale optimization algorithm. The empirical analysis was carried out through 8 data sets. According to the experimental results, three main conclusions can be drawn. First, the proposed model in this paper has excellent prediction performance and robustness. In all the comparison experiments, the R² and RMSE of the proposed model are the best among all the models. Second, data preprocessing is very necessary. After adding the decomposition algorithm, the average improvement levels of R² and RMSE were 897.57% and 50.78%, respectively. Third, the re-decomposition of IMF1 is an effective method to improve prediction accuracy. After the re-decomposition of IMF1, R² can be improved by 13.64% on average on the original basis, and RMSE can be reduced by 31.99% on average. The results of this study can provide a valuable reference for the research of air pollutant prediction. In future work, the application of the proposed model in other air pollutants or other regions can be explored.
Показать больше [+] Меньше [-]Common patterns of functional and biotic indices in response to multiple stressors in marine harbours ecosystems
2020
D’Alessandro, Michela | Porporato, Erika M.D. | Esposito, Valentina | Giacobbe, Salvatore | Deidun, Alain | Nasi, Federica | Ferrante, Larissa | Auriemma, Rocco | Berto, Daniela | Renzi, Monia | Scotti, Gianfranco | Consoli, Pierpaolo | Del Negro, Paola | Andaloro, Franco | Romeo, Teresa
Evaluating the effects of anthropogenic pressure on the marine environment is one of the focal objectives in identifying strategies for its use, conservation and restoration. In this paper, we assessed the effects of chemical pollutants, grain size and plastic litter on functional traits, biodiversity and biotic indices. The study was conducted on the benthic communities of three harbours in the central Mediterranean Sea: Malta, Augusta and Syracuse, subjected to different levels of anthropogenic stress (high, medium and low, respectively). Six traits were considered, subdivided into 22 categories: reproductive frequency, environmental position, mobility, life habit, feeding habit and bioturbation. Functional diversity indices analysed were: Functional Divergence, Quadratic Entropy, Functional Evenness and Functional Richness. To assess the trait responses to environmental gradients, we applied RLQ analysis, which considers simultaneously the relationship between three components: environmental data (R), species abundances (L) and species traits (Q). From our analyses, significant relationships (P-value = 0.0018 for permutation of samples, and P-value = 0.00027 for permutation of species) between functional traits and environmental data were highlighted. The trait categories significantly influenced by environmental variables were those representing feeding habits and mobility. In particular, the first category was influenced by chemical pollutants (organotin compounds and polycyclic aromatic hydrocarbons) and grain size (silt and sand), while the latter category was influenced only by chemical pollutants.Pearson correlations performed for functional vs biotic and diversity indices confirmed the validity of the chosen conceptual framework for harbour environments. Finally, linear models assessing the influence of stressors on functional parameters underlined the link between environmental data vs benthic and functional indices. Our results highlight the fact that functional trait analysis provides a useful and fast method for detecting in greater depth the effects of multiple stressors on functional diversity in marine ecosystems.
Показать больше [+] Меньше [-]Evaluation of the natural attenuation capacity of urban residential soils with ecosystem-service performance index (EPX) and entropy-weight methods
2018
Xie, Tian | Wang, Meie | Su, Chao | Chen, Weiping
Soils provide the service of attenuating and detoxifying pollutants. Such ability, natural attenuation capacity (NAC), is one of the most important ecosystem services for urban soils. We improved the ecosystem-service performance index (EPX) model by integrating with entropy weight determination method to evaluate the NAC of residential soils in Beijing. Eleven parameters related to the soil process of pollutants fate and transport were selected and 115 residential soil samples were collected. The results showed that bulk density, microbial functional diversity and soil organic matter had high weights in the NAC evaluation. Urban socio-economic indicators of residential communities such as construction age, population density and property & management fee could be employed in kinetic fittings of NAC. It could be concluded urbanization had significant impacts on NAC in residential soils. The improved method revealed reasonable and practical results, and it could be served as a potential measure for application to other quantitative assessment.
Показать больше [+] Меньше [-]Statistical polarization in greenhouse gas emissions: Theory and evidence
2017
Remuzgo, Lorena | Trueba, Carmen
The current debate on climate change is over whether global warming can be limited in order to lessen its impacts. In this sense, evidence of a decrease in the statistical polarization in greenhouse gas (GHG) emissions could encourage countries to establish a stronger multilateral climate change agreement. Based on the interregional and intraregional components of the multivariate generalised entropy measures (Maasoumi, 1986), Gigliarano and Mosler (2009) proposed to study the statistical polarization concept from a multivariate view. In this paper, we apply this approach to study the evolution of such phenomenon in the global distribution of the main GHGs. The empirical analysis has been carried out for the time period 1990–2011, considering an endogenous grouping of countries (Aghevli and Mehran, 1981; Davies and Shorrocks, 1989). Most of the statistical polarization indices showed a slightly increasing pattern that was similar regardless of the number of groups considered. Finally, some policy implications are commented.
Показать больше [+] Меньше [-]Fabrication of activated carbon supported modified with bimetallic-platin ruthenium nano sorbent for removal of azo dye from aqueous media using enhanced ultrasonic wave
2022
Herein, activated carbon supported modified with bimetallic-platin ruthenium nano sorbent (PtRu@AC) was synthesized by a thermal decomposition process and used in the removal of methylene blue (MB) from aqueous solutions. The synthesized nano sorbents were characterized by X-ray Diffraction (XRD), Transmission Electron Microscopy (TEM), and X-ray Photoelectron Spectroscopy (XPS) spectroscopic techniques. The data obtained from characterization studies showed that PtRu@AC nano sorbent was highly crystalline and in a form of PtRu alloy with a monodispersed composition. The results indicated that the maximum adsorption capacity (qemax) for the removal of MB with PtRu@AC under optimum conditions was detected to be 1.788 mmol/g (569.4 mg/g). The experimental kinetic results of the study revealed that the adsorption of methylene blue was found to be more compatible with the false second-order model compared to some tested models. Calculations for thermodynamic functions including enthalpy change (ΔHo), entropy change (ΔSo), and Gibbs free energy change (ΔGo) values were performed to get an idea about the adsorption mechanism. As a result, the synthesized PtRu@AC nano adsorbent was detected as a highly effective adsorbent material in the removal of MB from aquatic mediums.
Показать больше [+] Меньше [-]Adsorption performance and mechanism of cationic and anionic dyes by KOH activated biochar derived from medical waste pyrolysis
2022
Ullah, Fahim | Ji, Guozhao | Irfan, Muhammad | Gao, Yuan | Shafiq, Farishta | Sun, Ye | Ain, Qurat Ul | Li, Aimin
The massive generation of medical waste (MW) results in a series of environmental, social, and ecological problems. Pyrolysis is one such approach that has attracted more attention because of the production of value-added products with lesser environmental risk. In this study, the activated biochar (ABC600) was obtained from MW pyrolysis and activated with KOH. The adsorption mechanism of activated biochar on cationic (methylene blue) and anionic (reactive yellow) dyes were studied. The physicochemical characterization of biochar showed that increasing pyrolysis temperature and KOH activation resulted in increased surface area, a rough surface with a clear porous structure, and sufficient functional groups. MB and RYD-145 adsorption on ABC600 was more consistent with Langmuir isotherm (R² ≥ 0.996) and pseudo-second-order kinetics (R² ≥ 0.998), indicating chemisorption with monolayer characteristics. The Langmuir model fitting demonstrated that MB and RYD-145 had maximum uptake capacities of 922.2 and 343.4 mg⋅g⁻¹. The thermodynamics study of both dyes showed a positive change in enthalpy (ΔH°) and entropy (ΔS°), revealing the endothermic adsorption behavior and randomness in dye molecule arrangement on activated-biochar/solution surface. The activated biochar has excellent adsorption potential for cationic and anionic dyes; hence, it can be considered an economical and efficient adsorbent.
Показать больше [+] Меньше [-]Single spectral imagery and faster R-CNN to identify hazardous and noxious substances spills
2020
Huang, Hui | Wang, Chao | Liu, Shuchang | Sun, Zehao | Zhang, Dezhun | Liu, Caicai | Jiang, Yang | Zhan, Shuyue | Zhang, Haofei | Xu, Ren
The automatic identification (location, segmentation, and classification) by UAV- based optical imaging of spills of transparent floating Hazardous and Noxious Substances (HNS) benefits the on-site response to spill incidents, but it is also challenging. With a focus on the on-site optical imaging of HNS, this study explores the potential of single spectral imaging for HNS identification using the Faster R-CNN architecture. Images at 365 nm (narrow UV band), blue channel images (visible broadband of ∼400–600 nm), and RGB images of typical HNS (benzene, xylene, and palm oil) in different scenarios were studied with and without Faster R-CNN. Faster R-CNN was applied to locate and classify the HNS spills. The segmentation using Faster R-CNN-based methods and the original masking methods, including Otsu, Max entropy, and the local fuzzy thresholding method (LFTM), were investigated to explore the optimal wavelength and corresponding image processing method for the optical imaging of HNS. We also compared the classification and segmentation results of this study with our previously published studies on multispectral and whole spectral images. The results demonstrated that single spectral UV imaging at 365 nm combined with Faster R-CNN has great potential for the automatic identification of transparent HNS floating on the surface of the water. RGB images and images using Faster R-CNN in the blue channel are capable of HNS segmentation.
Показать больше [+] Меньше [-]Noncovalent interactions between fluoroquinolone antibiotics with dissolved organic matter: A 1H NMR binding site study and multi-spectroscopic methods
2019
Zhao, Xiating | Hu, Zhongzheng | Yang, Xing | Cai, Xuewei | Wang, Zhaowei | Xie, Xiaoyun
Fluoroquinolone antibiotics (FQs) are considered to be emerging environmental contaminants that have been detected extensively in aquatic environment. It is of quite importance to explore FQs interacting with dissolved organic matter (DOM). The interactions of FQs with DOM were examined by nuclear magnetic resonance (NMR) spectroscopy, fluorescence quenching, UV–vis, Fourier transform infrared (FT-IR) spectroscopic techniques. The bindings of FQs to DOM had one single binding site and their quenching mechanisms were static, which were evaluated by the Stern-Volmer and Site-binding equations. Addition of DOM could result in micro-environmental changes of fluorophores groups in FQs. The location adjacent oxygen right of Ofloxacin (OFL) and the aromatic ring (the adjacency replaced by two nitrogen-containing groups) of Ciprofloxacin (CIP), Enrofloxacin (ENR), Norfloxacin (NOR) might be highly affected by DOM molecule. The negative enthalpy change (ΔH⁰), negative entropy change (ΔS⁰) and the positive Gibbs' energy change (ΔG⁰) figured out that the binding processes were exothermic but not thermodynamic favorable, the formation of HA-FQs complexes would be powered chiefly by the ΔS⁰. H-bonding, electrostatic effect, van der Waals force were the acting force in the binding reactions and the π-π stacking effect was the major binding force under alkaline conditions. Moreover, the protonated, deprotonated, or partially protonated state of FQs were found to have different binding capacity to DOM, and the binding reactions for FQs-HA system were suppressed as the ionic strength increased. Meanwhile, alterations of FQs conformation in the presence of DOM were evaluated by FT-IR and UV–vis spectra.
Показать больше [+] Меньше [-]Lead binding to wild metal-resistant bacteria analyzed by ITC and XAFS spectroscopy
2019
Chen, Hansong | Xu, Jinling | Tan, Wenfeng | Fang, Linchuan
Metal-resistant bacteria can survive exposure to high metal concentrations without any negative impact on their growth. Biosorption is considered to be one of the more effective detoxification mechanisms acting in most bacteria. However, molecular-scale characterization of metal biosorption by wild metal-resistant bacteria has been limited. In this study, the Pb(II) biosorption behavior of Serratia Se1998 isolated from Pb-contaminated soil was investigated through macroscopic and microscopic techniques. A four discrete site non-electrostatic model fit the potentiometric titration data best, suggesting a distribution of phosphodiester, carboxyl, phosphoryl, and amino or hydroxyl groups on the cell surface. The presence of these functional groups was verified by the attenuated total reflection Fourier transform infrared (ATR-FTIR) spectroscopy, which also indicated that carboxyl and phosphoryl sites participated in Pb(II) binding simultaneously. The negative enthalpy (−9.11 kJ mol−1) and large positive entropy (81.52 J mol−1 K−1) of Pb(II) binding with the bacteria suggested the formation of inner-sphere complexes by an exothermic process. X-ray absorption fine structure (XAFS) analysis further indicated monodentate inner-sphere binding of Pb(II) through formation of C−O−Pb and P−O−Pb bonds. We inferred that C−O−Pb bonds formed on the flagellar surfaces, establishing a self-protective barrier against exterior metal stressors. This study has important implications for an improved understanding of metal-resistance mechanisms in wild bacteria and provides guidance for the construction of genetically engineered bacteria for remediation purposes.
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