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A Modeling Approach to Compare ΣPCB Concentrationsrnbetween Congener-Specific Analyses

机译:比较同类分析之间ΣPCB浓度的一种建模方法

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摘要

Changes in analytical methods over time pose problems for assessing long-term trends in environmental contamination byrnPCBs. Congener-specific analyses vary widely in the number and identity of the 209 distinct PCB chemical configurationsrn(congeners) that are quantified, leading to inconsistencies among summed PCB concentrations (SPCB) reported by differentrnstudies. Here, we present a modeling approach using linear regression to compare SPCB concentrations derived fromrndifferent congener-specific analyses measuring different co-eluting groups. The approach can be used to develop a specificrnconversion model between any 2 sets of congener-specific analytical data from similar samples (similar matrix and geographicrnorigin). We demonstrate the method by developing a conversion model for an example data set that includes data from 2rndifferent analytical methods, a low resolution method quantifying 119 congeners and a high resolution method quantifying allrn209 congeners.We used the model to show that the 119-congener set captured most (93%) of the total PCB concentration (i.e.,rnS209PCB) in sediment and biological samples. SPCB concentrations estimated using the model closely matched measuredrnvalues (mean relative percent difference¼9.6). General applications of the modeling approach include 1) generatingrncomparable SPCB concentrations for samples that were analyzed for different congener sets; and 2) estimating thernproportional contribution of different congener sets to SPCB. This approach may be especially valuable for enablingrncomparison of long-term remediation monitoring results even as analytical methods change over time.
机译:随着时间的流逝,分析方法的变化给评估PCB造成的环境污染的长期趋势带来了问题。同类物特定的分析在对209种不同的PCB化学结构(同类物)进行量化的数量和特性方面差异很大,导致不同研究报告的PCB总浓度(SPCB)之间不一致。在这里,我们提出了一种使用线性回归的建模方法,以比较源自测量不同共洗脱组的不同同类物特异性分析得出的SPCB浓度。该方法可用于在来自相似样本(相似矩阵和geographicnorigin)的任意两组同类物特定分析数据之间建立特定的转换模型。我们通过为一个示例数据集开发转换模型来演示该方法,该模型包括来自2种不同分析方法的数据,量化119个同类物的低分辨率方法和量化allrn209个同类物的高分辨率方法。我们使用该模型显示了119个同类物在沉积物和生物样品中捕获了总PCB浓度(即rnS209PCB)中的大部分(93%)。使用该模型估算的SPCB浓度与测得的值非常匹配(平均相对百分比差异¼9.6)。建模方法的一般应用包括:1)为分析不同同类集的样品生成可比较的SPCB浓度; 2)估计不同同类集对SPCB的比例贡献。即使分析方法随时间变化,这种方法对于长期补救监测结果的比较也可能特别有价值。

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