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When high accuracy misleads: Stability limits of supervised feature importance in QSAR biodegradation 当高精度误导:QSAR生物降解中监督特征重要性的稳定性限制
IF 8.1 2区 环境科学与生态学 Q1 ENVIRONMENTAL SCIENCES Pub Date : 2026-03-01 Epub Date: 2026-01-29 DOI: 10.1016/j.chemosphere.2026.144846
Yoshiyasu Takefuji
Supervised machine learning excels at target prediction but can mischaracterize structure–biodegradability associations when feature importance is treated as ground truth. Using the QSAR Biodegradation dataset (1055 chemicals; 41 descriptors), we compare targeted supervised models (random forest, XGBoost, logistic regression), unsupervised methods (feature agglomeration, highly variable gene selection), and non-targeted supervised approaches (Spearman correlation). We evaluate cross-validated accuracy and ranking stability via a top-10 selection protocol and a leave-top-1-out perturbation. XGBoost attains the highest accuracy (0.8569) yet exhibits ranking instability; random forests are similarly unstable. In contrast, unsupervised and non-targeted supervised methods achieve strong accuracy (≈0.819–0.849) with perfect stability. Results caution against equating high predictive accuracy with reliable feature importance and support stability-aware, label-agnostic selection for interpretable materials science.
监督机器学习在目标预测方面表现出色,但当特征重要性被视为基本事实时,可能会错误地描述结构-生物降解性关联。使用QSAR生物降解数据集(1055种化学物质;41个描述符),我们比较了目标监督模型(随机森林,XGBoost,逻辑回归),无监督方法(特征聚集,高度可变的基因选择)和非目标监督方法(Spearman相关)。我们评估交叉验证的准确性和排名稳定性通过前10名的选择协议和留下前1名的扰动。XGBoost达到最高的精度(0.8569),但表现出排名不稳定;随机森林同样不稳定。相比之下,无监督和非目标监督方法具有较强的准确率(≈0.819-0.849)和较好的稳定性。结果警告不要将高预测准确性与可靠的特征重要性等同起来,并支持可解释材料科学的稳定性意识,标签不可知选择。
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引用次数: 0
Construction of immobilized direct Z-scheme ZnS QDs-Fe2O3 QDs|430-SSF photocatalyst film for methylene blue degradation with simultaneous hydrogen production 固定化直接Z-scheme ZnS QDs- fe2o3 QDs bbb430 - ssf光催化膜的构建
IF 8.1 2区 环境科学与生态学 Q1 ENVIRONMENTAL SCIENCES Pub Date : 2026-03-01 Epub Date: 2026-02-19 DOI: 10.1016/j.chemosphere.2026.144864
Yingying Zhang , Jince Zhang , Kehang Xiao , Xue An , Dawei Fang , Jun Wang
Traditional photocatalysts have the disadvantages of low sunlight utilization efficiency, weak interaction with contaminants and difficulty in recycling. In this study, ZnS QDs and Fe2O3 QDs prepared by hydrodynamic cavitation method and 430 stainless steel foil (430-SSF) are used to synthesize immobilized direct Z-scheme photocatalyst film. This photocatalytic has higher sunlight utilization rate, organic contaminants degradation and hydrogen production. Moreover, the small size and large specific surface area of quantum dots can enable photocatalysts to provide more reactive sites, increasing contact probability between contaminants and catalyst. ZnS QDs-Fe2O3 QDs heterojunction is constructed through hydrothermal reaction and coated on 430-SSF to prepare the photocatalyst film with 38.4 μm thickness. This design scheme completely overcomes the above defects. The experimental results show degradation efficiency of MB reaches 89.46% and hydrogen production reaches 422.5 μmol under simulated sunlight irradiation for 3.0h when mass proportion of ZnS QDs and Fe2O3 QDs is 1:3. The degradation efficiencies of MB using ZnS QDs-Fe2O3 QDs composite as photocatalyst are 2.19 times and 11.1 times higher than ones of using ZnS QDs and Fe2O3 QDs alone. More importantly, after multiple cycles of use, the performance and hydrogen production efficiency of photocatalyst show little decline, indicating excellent structural stability and good reusability. This research provides an innovative and practical idea for the preparation of immobilized direct Z-scheme photocatalysts for the efficient degradation of organic contaminants and simultaneous hydrogen production, which is of great significance for promoting large-scale application of photocatalytic technology in wastewater treatment and clean energy production.
传统光催化剂存在光能利用率低、与污染物相互作用弱、回收困难等缺点。本研究以流体动力空化法制备的ZnS量子点和Fe2O3量子点与430不锈钢箔(430- ssf)为材料,合成了固定化直接z型光催化剂薄膜。该光催化剂具有较高的光能利用率、降解有机污染物和产氢性能。此外,量子点的小尺寸和大比表面积可以使光催化剂提供更多的反应位点,增加污染物与催化剂之间的接触概率。通过水热反应构建ZnS QDs- fe2o3 QDs异质结,并在430-SSF上涂覆,制备了厚度为38.4 μm的光催化膜。本设计方案完全克服了上述缺陷。实验结果表明,当ZnS量子点与Fe2O3量子点质量比为1:3时,模拟阳光照射3.0h, MB的降解效率达到89.46%,产氢量达到422.5 μmol。ZnS QDs-Fe2O3 QDs复合光催化剂对MB的降解效率分别是单独使用ZnS QDs和Fe2O3 QDs的2.19倍和11.1倍。更重要的是,经过多次循环使用,光催化剂的性能和产氢效率几乎没有下降,表明其结构稳定性好,可重复使用性好。本研究为制备固定化直接z型光催化剂高效降解有机污染物并同时产氢提供了创新和实用思路,对促进光催化技术在废水处理和清洁能源生产中的大规模应用具有重要意义。
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引用次数: 0
Green solvents for the extraction and bioutilisation of metals from coal fly ash by Magnetospirillum gryphiswaldense MSR1 用gryphiswaldense Magnetospirillum MSR1从粉煤灰中提取和生物利用金属的绿色溶剂。
IF 8.1 2区 环境科学与生态学 Q1 ENVIRONMENTAL SCIENCES Pub Date : 2026-03-01 Epub Date: 2026-02-03 DOI: 10.1016/j.chemosphere.2026.144839
Josh Bond , Marta Maso-Martinez , Andrew Sutherland , Tim William Overton , Andrew Goddard , Vesna Najdanovic , Daniel M. Chevrier , Miguel A. Gomez Gonzalez , Alfred Fernandez-Castane
Coal fly ash (CFA), a metal-rich byproduct of coal combustion is produced in vast quantities and poses significant ecological risks. CFA also contains abundant technologically relevant metal oxides and trace metals, including rare earth elements (REE), often at higher concentrations than in primary ores. This makes sustainable recovery strategies a major industrial opportunity. Here, green solvent systems were applied to leach metals from CFA, and the resulting leachates were added to cultures of Magnetospirillum gryphiswaldense (MSR1), a model magnetotactic bacterium that biomineralizes iron into membrane-bound magnetic nanoparticles (magnetosomes) and is capable of interacting with non-iron metals through adsorption and biomineralization. Eleven green solvents, including deep eutectic solvents (DES), were tested for extraction efficiency, with six showing performance comparable to a mineral acid control. Copper (Cu) emerged as the primary toxicant to MSR1, prompting selective precipitation with potassium ferrocyanide trihydrate (PFCT) to reduce its concentration. Cu-depleted lactic acid-based leachates supported MSR1 growth and magnetosome formation even without supplemented iron. Nano-XRF and ICP-MS analysis revealed MSR1 interacts with CFA-derived metals, most significantly showing that produced CFA magnetosomes contained a 5.3–6.1-fold increase in Cu compared to controls. As Cu is both a growth inhibitor and a target pollutant, these findings suggest MSR1 may bioaccumulate Cu within magnetosomes as a detoxification strategy. Overall, this study demonstrates a combined chemical–biological route for CFA valorisation, enabling recovery of diverse metals from waste while producing magnetosomes with distinct compositions.
煤飞灰是煤燃烧产生的一种富含金属的副产物,其产生量巨大,具有重大的生态风险。CFA还含有丰富的与技术相关的金属氧化物和微量金属,包括稀土元素(REE),其浓度往往高于原生矿石。这使得可持续复苏战略成为一个重大的工业机遇。在这里,绿色溶剂系统被应用于从CFA中浸出金属,所得的浸出液被添加到gryphiswaldense磁螺旋藻(MSR1)的培养物中,MSR1是一种模型趋磁细菌,它将铁生物矿化成膜结合的磁性纳米颗粒(磁小体),并能够通过吸附和生物矿化与非铁金属相互作用。包括深共晶溶剂(DES)在内的11种绿色溶剂对萃取效率进行了测试,其中6种溶剂表现出与矿物酸对照相当的性能。铜(Cu)成为MSR1的主要毒物,促使三水合亚铁氰化钾(PFCT)选择性沉淀以降低其浓度。即使没有补充铁,缺铜乳酸基渗滤液也支持MSR1生长和磁小体形成。纳米xrf和ICP-MS分析显示,MSR1与CFA衍生金属相互作用,最显著的是,与对照组相比,产生的CFA磁小体含有5.3-6.1倍的Cu。由于铜既是生长抑制剂又是目标污染物,这些发现表明MSR1可能在磁小体中生物积累铜作为解毒策略。总的来说,这项研究展示了一种化学-生物结合的CFA增值途径,能够从废物中回收各种金属,同时生产具有不同成分的磁小体。
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引用次数: 0
Ionic liquids towards safer solvents: Toxicity and its assessment by physical and computational methods 离子液体趋向更安全的溶剂:毒性及其物理和计算方法的评估。
IF 8.1 2区 环境科学与生态学 Q1 ENVIRONMENTAL SCIENCES Pub Date : 2026-03-01 Epub Date: 2026-02-26 DOI: 10.1016/j.chemosphere.2026.144874
N.O. Atamas , K.S. Yablochkova , I.P. Matushko , M.M. Lazarenko
This review examines various aspects of ionic liquid (IL) toxicity related to the structure of ions and cations, as well as methodologies for their study, from in vitro studies to computer models. All discussed approaches focus on their use in assessing the potential environmental risks associated with ILs and their toxicity to living organisms. The synthesis of various integrated approaches to IL toxicity analysis provides a comprehensive framework for understanding the implications of their use in the chemical and pharmaceutical industries. This review promotes further research into the properties of ILs, including toxicity assessment, which should lead to the development of common approaches and a regulatory framework for IL toxicity analysis.
本文综述了离子液体(IL)毒性与离子和阳离子结构有关的各个方面,以及它们的研究方法,从体外研究到计算机模型。所有讨论的方法都侧重于它们在评估与il相关的潜在环境风险及其对生物体的毒性方面的应用。综合各种综合方法的IL毒性分析提供了一个全面的框架,以了解其在化学和制药工业中使用的影响。这篇综述促进了对白介素特性的进一步研究,包括毒性评估,这将导致白介素毒性分析的共同方法和监管框架的发展。
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引用次数: 0
Influence of anaerobic digestate and wood ash on phenanthrene bioaccessibility and mineralisation in soil 厌氧沼液和木灰对土壤中菲生物可及性和矿化的影响
IF 8.1 2区 环境科学与生态学 Q1 ENVIRONMENTAL SCIENCES Pub Date : 2026-03-01 Epub Date: 2026-01-30 DOI: 10.1016/j.chemosphere.2026.144845
Adesola S. Ojo, Chisom Ejileugha, Carly J. Stevens, Kirk T. Semple
The environmental persistence and ecotoxicity of polycyclic aromatic hydrocarbons (PAHs) have stimulated considerable interest in understanding their bioaccessibility and biodegradation in soils. Factors such as contact time, organic amendments, and microbial inoculation can influence these processes. This study examined how contact time, bacterial inoculation, and amendments affect the chemical extractability and biodegradation of 9-14C-phenanthrene in soil. Soils were amended with anaerobic digestate (AD), wood ash (WA), or their combination (AD + WA) and monitored over 90 days. Lower recoveries of 9-14C-phenanthrene activity were observed in amended soils compared with the control, particularly in AD + WA treatments, with recoveries declining over time. Both dichloromethane (DCM) and hydroxypropyl-β-cyclodextrin (HP-β-CD) extractability decreased with increasing soil – PAH contact time, with a greater reduction in HP-β-CD extractability observed in AD + WA. Inoculated systems exhibited shorter lag phases than uninoculated systems, although bacterial numbers, mineralisation rates, and extents were similar across both inoculation conditions. Lower mineralisation extents occurred in AD + WA under both inoculation conditions. This study provides new insights into how AD, WA, and AD + WA influence PAH bioaccessibility and mineralisation kinetics in soil. The findings indicate that AD and/or WA can stimulate 9-14C-phenanthrene biodegradation under nutrient-limited conditions, primarily through biostimulation of indigenous microbial communities; however, bioaccessibility rather than nutrient availability or microbial abundance, ultimately constrained degradation endpoints. These results highlight the need for (bio)remediation strategies that enhance contaminant availability, rather than focusing solely on nutrient inputs or microbial abundance.
多环芳烃(PAHs)的环境持久性和生态毒性引起了人们对其在土壤中的生物可及性和生物降解的极大兴趣。诸如接触时间、有机改性剂和微生物接种等因素可以影响这些过程。本研究考察了接触时间、细菌接种和修正对土壤中9- 14c -菲的化学萃取性和生物降解性的影响。用厌氧消化液(AD)、木灰(WA)或它们的组合(AD + WA)对土壤进行了90天的监测。与对照相比,改良土壤中9- 14c -菲活性的恢复较低,特别是在AD + WA处理中,恢复随时间而下降。二氯甲烷(DCM)和羟丙基-β-环糊精(HP-β- cd)的可提取性随土壤-多环芳烃接触时间的增加而降低,其中AD + WA对HP-β- cd的可提取性降低幅度更大。接种系统比未接种系统表现出更短的滞后期,尽管两种接种条件下的细菌数量、矿化率和程度相似。两种接种条件下,AD + WA的矿化程度均较低。该研究为AD、WA和AD + WA如何影响土壤中多环芳烃的生物可及性和矿化动力学提供了新的见解。结果表明,在营养限制条件下,AD和/或WA主要通过生物刺激本地微生物群落来促进9- 14c -菲的生物降解;然而,生物可及性,而不是养分可利用性或微生物丰度,最终限制了降解终点。这些结果强调需要(生物)修复策略,以提高污染物的可用性,而不是仅仅关注营养投入或微生物丰度。
{"title":"Influence of anaerobic digestate and wood ash on phenanthrene bioaccessibility and mineralisation in soil","authors":"Adesola S. Ojo,&nbsp;Chisom Ejileugha,&nbsp;Carly J. Stevens,&nbsp;Kirk T. Semple","doi":"10.1016/j.chemosphere.2026.144845","DOIUrl":"10.1016/j.chemosphere.2026.144845","url":null,"abstract":"<div><div>The environmental persistence and ecotoxicity of polycyclic aromatic hydrocarbons (PAHs) have stimulated considerable interest in understanding their bioaccessibility and biodegradation in soils. Factors such as contact time, organic amendments, and microbial inoculation can influence these processes. This study examined how contact time, bacterial inoculation, and amendments affect the chemical extractability and biodegradation of 9-<sup>14</sup>C-phenanthrene in soil. Soils were amended with anaerobic digestate (AD), wood ash (WA), or their combination (AD + WA) and monitored over 90 days. Lower recoveries of 9-<sup>14</sup>C-phenanthrene activity were observed in amended soils compared with the control, particularly in AD + WA treatments, with recoveries declining over time. Both dichloromethane (DCM) and hydroxypropyl-β-cyclodextrin (HP-β-CD) extractability decreased with increasing soil – PAH contact time, with a greater reduction in HP-β-CD extractability observed in AD + WA. Inoculated systems exhibited shorter lag phases than uninoculated systems, although bacterial numbers, mineralisation rates, and extents were similar across both inoculation conditions. Lower mineralisation extents occurred in AD + WA under both inoculation conditions. This study provides new insights into how AD, WA, and AD + WA influence PAH bioaccessibility and mineralisation kinetics in soil. The findings indicate that AD and/or WA can stimulate 9-<sup>14</sup>C-phenanthrene biodegradation under nutrient-limited conditions, primarily through biostimulation of indigenous microbial communities; however, bioaccessibility rather than nutrient availability or microbial abundance, ultimately constrained degradation endpoints. These results highlight the need for (bio)remediation strategies that enhance contaminant availability, rather than focusing solely on nutrient inputs or microbial abundance.</div></div>","PeriodicalId":276,"journal":{"name":"Chemosphere","volume":"396 ","pages":"Article 144845"},"PeriodicalIF":8.1,"publicationDate":"2026-03-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146075898","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"环境科学与生态学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Thermal desorption as an environmentally sound alternative for the determination of high production volume chemicals and polycyclic aromatic hydrocarbons in particulate matter 热解吸作为一种环境友好的替代方法,可用于测定颗粒物质中的高产量化学品和多环芳烃
IF 8.1 2区 环境科学与生态学 Q1 ENVIRONMENTAL SCIENCES Pub Date : 2026-03-01 Epub Date: 2026-02-12 DOI: 10.1016/j.chemosphere.2026.144865
Laura Solé-Domènech , Laura Vallecillos , Alexandre Fabregat , Francesc Borrull
Particulate matter (PM) is a key component of air pollution, not only because of its own effects on human health but also because of certain semi-volatile organic compounds (SVOCs) which can be carried on its surface, such as benzothiazoles, phthalate esters (PAEs), ultraviolet stabilizers and polycyclic aromatic hydrocarbons (PAHs). Developing analytical methods for the determination of these compounds on PM samples is essential, especially in the light of current trends in the analytical processes such as automation and green chemistry. In this study, a method based on thermal desorption coupled to gas chromatography-mass spectrometry (TD-GC-MS) was developed and validated for the determination of 17 high production volume chemicals (HPVCs) and 13 PAHs at pg m−3 levels and evaluated using AGREEprep, with an overall score of 0.68.
The method was applied to PM10 air samples collected from the Port of Tarragona. The most representative target compounds were PAEs, accounting for 72% of the total and with the widest concentration ranges. Out of them, diethylhexyl phthalate (DEHP) was the most prevalent compound, with concentrations between 2647 pg m−3 and 5298 pg m−3. The family of PAHs accounted for 17% of the total with a mean value of 9823 pg m−3. Benzo(a)pyrene (BaP), which is regulated to a maximum annual average concentration of 1000 pg m−3 in PM10 by the European Directive , 2024/2881, was not detected in any of the samples analysed; hence, its concentration was below the regulatory limit.
颗粒物(PM)是空气污染的一个关键组成部分,不仅因为它本身对人类健康的影响,而且还因为某些半挥发性有机化合物(SVOCs)可以携带在其表面,如苯并噻唑、邻苯二甲酸酯(PAEs)、紫外线稳定剂和多环芳烃(PAHs)。开发PM样品上这些化合物的分析方法至关重要,特别是考虑到当前分析过程的趋势,如自动化和绿色化学。本研究建立了一种基于热解吸-气相色谱-质谱联用(tg - gc - ms)的方法,并对该方法进行了验证,用于测定17种高产化学物质(HPVCs)和13种PAHs (pg m−3)水平,并使用AGREEprep进行了评估,总体得分为0.68。将该方法应用于塔拉戈纳港的PM10空气样本。最具代表性的目标化合物是PAEs,占总数的72%,浓度范围最广。其中,邻苯二甲酸二乙基己酯(DEHP)是最普遍的化合物,浓度在2647 pg m−3和5298 pg m−3之间。多环芳烃族占总数的17%,平均值为9823 pg m−3。在分析的任何样品中均未检测到苯并(a)芘(BaP),该物质在PM10中的最大年平均浓度被欧洲指令2024/2881规定为1000 pg m−3;因此,其浓度低于规定限值。
{"title":"Thermal desorption as an environmentally sound alternative for the determination of high production volume chemicals and polycyclic aromatic hydrocarbons in particulate matter","authors":"Laura Solé-Domènech ,&nbsp;Laura Vallecillos ,&nbsp;Alexandre Fabregat ,&nbsp;Francesc Borrull","doi":"10.1016/j.chemosphere.2026.144865","DOIUrl":"10.1016/j.chemosphere.2026.144865","url":null,"abstract":"<div><div>Particulate matter (PM) is a key component of air pollution, not only because of its own effects on human health but also because of certain semi-volatile organic compounds (SVOCs) which can be carried on its surface, such as benzothiazoles, phthalate esters (PAEs), ultraviolet stabilizers and polycyclic aromatic hydrocarbons (PAHs). Developing analytical methods for the determination of these compounds on PM samples is essential, especially in the light of current trends in the analytical processes such as automation and green chemistry. In this study, a method based on thermal desorption coupled to gas chromatography-mass spectrometry (TD-GC-MS) was developed and validated for the determination of 17 high production volume chemicals (HPVCs) and 13 PAHs at pg m<sup>−3</sup> levels and evaluated using AGREEprep, with an overall score of 0.68.</div><div>The method was applied to PM<sub>10</sub> air samples collected from the Port of Tarragona. The most representative target compounds were PAEs, accounting for 72% of the total and with the widest concentration ranges. Out of them, diethylhexyl phthalate (DEHP) was the most prevalent compound, with concentrations between 2647 pg m<sup>−3</sup> and 5298 pg m<sup>−3</sup>. The family of PAHs accounted for 17% of the total with a mean value of 9823 pg m<sup>−3</sup>. Benzo(<em>a</em>)pyrene (BaP), which is regulated to a maximum annual average concentration of 1000 pg m<sup>−3</sup> in PM<sub>10</sub> by the European Directive , 2024/2881, was not detected in any of the samples analysed; hence, its concentration was below the regulatory limit.</div></div>","PeriodicalId":276,"journal":{"name":"Chemosphere","volume":"396 ","pages":"Article 144865"},"PeriodicalIF":8.1,"publicationDate":"2026-03-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146171335","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"环境科学与生态学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Editorial for the Special Issue “Micro-and nanoplastics in soil: Insights and challenges” 特刊社论“土壤中的微和纳米塑料:见解和挑战”。
IF 8.1 2区 环境科学与生态学 Q1 ENVIRONMENTAL SCIENCES Pub Date : 2026-03-01 Epub Date: 2026-02-23 DOI: 10.1016/j.chemosphere.2026.144871
Albert A. Koelmans , Stefan Krause , Petra Krystek
{"title":"Editorial for the Special Issue “Micro-and nanoplastics in soil: Insights and challenges”","authors":"Albert A. Koelmans ,&nbsp;Stefan Krause ,&nbsp;Petra Krystek","doi":"10.1016/j.chemosphere.2026.144871","DOIUrl":"10.1016/j.chemosphere.2026.144871","url":null,"abstract":"","PeriodicalId":276,"journal":{"name":"Chemosphere","volume":"397 ","pages":"Article 144871"},"PeriodicalIF":8.1,"publicationDate":"2026-03-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"147286656","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"环境科学与生态学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Microplastics in sediments: A systematic review structured through reproducible analytical pipelines 沉积物中的微塑料:通过可重复分析管道构建的系统综述
IF 8.1 2区 环境科学与生态学 Q1 ENVIRONMENTAL SCIENCES Pub Date : 2026-03-01 Epub Date: 2026-01-30 DOI: 10.1016/j.chemosphere.2026.144849
Madeline Jefroy , Amy Lusher , Bert van Bavel , Peygham Ghaffari
Microplastic research has expanded rapidly, yet substantial methodological variability continues to limit comparability across sediment studies. To characterize current practice and identify priority areas for harmonization, we conducted a systematic literature review (SLR) of 3290 records, from which 37 sediment-focused studies (18 marine, 19 freshwater) met the inclusion criteria. Methods were analyzed using a Reproducible Analytical Pipelines (RAPs) framework encompassing sampling, preparation, detection, and polymer identification. Sampling approaches varied widely: grab samplers dominated (55% of marine and 42% of freshwater studies), while corers (28% and 16%) and manual tools (5% and 16%) were less frequently used. Lower size thresholds spanned <0.11mm, with <0.1 mm most common in marine studies (45%) and less so in freshwater systems (30%). Density separation was nearly universal (36 of 37 studies), with sodium chloride used in over 70% of workflows despite its limited ability to recover high-density polymers; denser media were employed in fewer than 25% of studies. Oxidative digestion was the dominant method for removing organic matter (81%). Polymer confirmation relied overwhelmingly on μFTIR (35 studies), whereas Raman spectroscopy appeared in only four studies, primarily for particles <0.1mm. Overall, the SLR reveals partial methodological convergence but persistent divergence in key analytical parameters, highlighting clear priorities for future harmonization efforts.
微塑料研究迅速扩大,但实质性的方法可变性继续限制沉积物研究的可比性。为了描述目前的实践并确定协调的优先领域,我们对3290份记录进行了系统的文献综述(SLR),其中37份以沉积物为重点的研究(18份海洋研究,19份淡水研究)符合纳入标准。方法采用可重复分析管道(RAPs)框架进行分析,包括取样、制备、检测和聚合物鉴定。采样方法差异很大:抓斗采样器占主导地位(55%的海洋和42%的淡水研究),而盖(28%和16%)和手动工具(5%和16%)的使用频率较低。较低的尺寸阈值范围为0.1 - 1mm,其中0.1 mm在海洋研究中最常见(45%),在淡水系统中较少(30%)。密度分离几乎是通用的(37项研究中有36项),尽管氯化钠回收高密度聚合物的能力有限,但它在70%以上的工作流程中使用;在不到25%的研究中使用了高密度介质。氧化消化是去除有机物的主要方法(81%)。聚合物的确认绝大多数依赖于μFTIR(35项研究),而拉曼光谱仅出现在4项研究中,主要用于0.1mm的颗粒。总体而言,SLR揭示了方法上的部分趋同,但关键分析参数上的持续分歧,突出了未来协调工作的明确优先事项。
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引用次数: 0
Comparison of per- and polyfluoroalkyl levels in human matrices, surface and drinking waters in Spain and other countries 西班牙和其他国家人体基质、地表水和饮用水中全氟烷基和多氟烷基含量的比较
IF 8.1 2区 环境科学与生态学 Q1 ENVIRONMENTAL SCIENCES Pub Date : 2026-03-01 Epub Date: 2026-02-11 DOI: 10.1016/j.chemosphere.2026.144855
M.P. Mayor , N. Díaz-Alejo , N. Boluda-Botella , M.D. Saquete
Per- and polyfluoroalkyl substances (PFAS) are persistent contaminants with widespread exposure. This review assesses PFAS levels in human and environmental matrices in Spain, focusing on exposure pathways, temporal trends, and treatment efficacy. Biomonitoring confirms persistent internal exposure, with median serum concentrations of PFOS (10460 ng/L) and PFOA (2720 ng/L) in specific regions, influenced by demographic factors, diet, and industrial proximity. Spatial patterns show higher concentrations in Northeast (Catalonia) and Northwest (Galicia) Spain, contrasting with the lowest levels in the Canary Islands. Environmental monitoring in the Ebro, Llobregat, and Júcar basins reveals highly variable concentrations; notably, the Llobregat exhibits elevated mean PFOS (234 ng/L) due to industrial discharges. While long-chain PFAS (PFOS, PFOA) have declined following regulations, highly mobile short-chain compounds (PFBA, PFPeA, PFBS) increasingly dominate rivers, tap water and protected areas like Albufera Natural Park. Regarding remediation, conventional treatment shows limited PFAS removal, whereas reverse osmosis and granular activated carbon yield significant reductions. Spanish PFAS levels remain comparable to those in the United States and Europe, generally falling below current health risk thresholds. However, the evolving profile and persistence of these contaminants underscore the need for harmonised monitoring, improved water treatment, and updated regulations, to safeguard long-term public health.
全氟和多氟烷基物质(PFAS)是广泛暴露的持久性污染物。本综述评估了西班牙人类和环境基质中PFAS的水平,重点关注暴露途径、时间趋势和治疗效果。生物监测证实了持续的内部暴露,在特定地区,全氟辛烷磺酸的中位血清浓度(10460 ng/L)和全氟辛烷磺酸(2720 ng/L)受到人口因素、饮食和工业邻近地区的影响。空间格局显示,西班牙东北部(加泰罗尼亚)和西北部(加利西亚)的浓度较高,而加那利群岛的浓度最低。Ebro、Llobregat和Júcar流域的环境监测显示浓度变化很大;值得注意的是,由于工业排放,Llobregat的全氟辛烷磺酸平均升高(234 ng/L)。随着法规的实施,长链PFAS (PFOS, PFOA)逐渐减少,高流动性的短链化合物(PFBA, PFPeA, PFBS)越来越多地支配着河流,自来水和保护区,如Albufera自然公园。在修复方面,常规处理对PFAS的去除效果有限,而反渗透和颗粒活性炭的去除效果显著。西班牙的全氟辛烷磺酸水平与美国和欧洲相当,普遍低于目前的健康风险阈值。然而,这些污染物不断变化的特征和持久性突出表明,需要统一监测、改进水处理和更新法规,以保障长期的公众健康。
{"title":"Comparison of per- and polyfluoroalkyl levels in human matrices, surface and drinking waters in Spain and other countries","authors":"M.P. Mayor ,&nbsp;N. Díaz-Alejo ,&nbsp;N. Boluda-Botella ,&nbsp;M.D. Saquete","doi":"10.1016/j.chemosphere.2026.144855","DOIUrl":"10.1016/j.chemosphere.2026.144855","url":null,"abstract":"<div><div>Per- and polyfluoroalkyl substances (PFAS) are persistent contaminants with widespread exposure. This review assesses PFAS levels in human and environmental matrices in Spain, focusing on exposure pathways, temporal trends, and treatment efficacy. Biomonitoring confirms persistent internal exposure, with median serum concentrations of PFOS (10460 ng/L) and PFOA (2720 ng/L) in specific regions, influenced by demographic factors, diet, and industrial proximity. Spatial patterns show higher concentrations in Northeast (Catalonia) and Northwest (Galicia) Spain, contrasting with the lowest levels in the Canary Islands. Environmental monitoring in the Ebro, Llobregat, and Júcar basins reveals highly variable concentrations; notably, the Llobregat exhibits elevated mean PFOS (234 ng/L) due to industrial discharges. While long-chain PFAS (PFOS, PFOA) have declined following regulations, highly mobile short-chain compounds (PFBA, PFPeA, PFBS) increasingly dominate rivers, tap water and protected areas like Albufera Natural Park. Regarding remediation, conventional treatment shows limited PFAS removal, whereas reverse osmosis and granular activated carbon yield significant reductions. Spanish PFAS levels remain comparable to those in the United States and Europe, generally falling below current health risk thresholds. However, the evolving profile and persistence of these contaminants underscore the need for harmonised monitoring, improved water treatment, and updated regulations, to safeguard long-term public health.</div></div>","PeriodicalId":276,"journal":{"name":"Chemosphere","volume":"396 ","pages":"Article 144855"},"PeriodicalIF":8.1,"publicationDate":"2026-03-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146171332","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"环境科学与生态学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Corrigendum to ‘Distribution of trace elements as electroactive species for environmental monitoring of estuarine waters in Pará river (AAmazonia, Brazil)’ [Chemosphere, volume 390 (2025) 144714] “par<s:1>河(亚马逊河,巴西)河口水域环境监测中作为电活性物质的微量元素分布”的勘误表[Chemosphere,卷390(2025)144714]。
IF 8.1 2区 环境科学与生态学 Q1 ENVIRONMENTAL SCIENCES Pub Date : 2026-03-01 Epub Date: 2026-02-05 DOI: 10.1016/j.chemosphere.2026.144853
Cristina Ramos Trindade , Kasley Barreto , Luis Felipe Formentini , Johnata Azevedo Ferreira , Letícia Lorena da Fonseca Santiago , Ruy Rodrigues Santiago Neto , Thaís Ramos Dal Molin , Lílian Lund Amado , Leandro Machado de Carvalho
{"title":"Corrigendum to ‘Distribution of trace elements as electroactive species for environmental monitoring of estuarine waters in Pará river (AAmazonia, Brazil)’ [Chemosphere, volume 390 (2025) 144714]","authors":"Cristina Ramos Trindade ,&nbsp;Kasley Barreto ,&nbsp;Luis Felipe Formentini ,&nbsp;Johnata Azevedo Ferreira ,&nbsp;Letícia Lorena da Fonseca Santiago ,&nbsp;Ruy Rodrigues Santiago Neto ,&nbsp;Thaís Ramos Dal Molin ,&nbsp;Lílian Lund Amado ,&nbsp;Leandro Machado de Carvalho","doi":"10.1016/j.chemosphere.2026.144853","DOIUrl":"10.1016/j.chemosphere.2026.144853","url":null,"abstract":"","PeriodicalId":276,"journal":{"name":"Chemosphere","volume":"396 ","pages":"Article 144853"},"PeriodicalIF":8.1,"publicationDate":"2026-03-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"146133831","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"环境科学与生态学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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