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221.
A novel approach to predict aquatic toxicity from molecular structure   总被引:1,自引:0,他引:1  
The main aim of the study was to develop quantitative structure-activity relationship (QSAR) models for the prediction of aquatic toxicity using atom-based non-stochastic and stochastic linear indices. The used dataset consist of 392 benzene derivatives, separated into training and test sets, for which toxicity data to the ciliate Tetrahymena pyriformis were available. Using multiple linear regression, two statistically significant QSAR models were obtained with non-stochastic (R2=0.791 and s=0.344) and stochastic (R2=0.799 and s=0.343) linear indices. A leave-one-out (LOO) cross-validation procedure was carried out achieving values of q2=0.781 (scv=0.348) and q2=0.786 (scv=0.350), respectively. In addition, a validation through an external test set was performed, which yields significant values of Rpred2 of 0.762 and 0.797. A brief study of the influence of the statistical outliers in QSAR's model development was also carried out. Finally, our method was compared with other approaches implemented in the Dragon software achieving better results. The non-stochastic and stochastic linear indices appear to provide an interesting alternative to costly and time-consuming experiments for determining toxicity.  相似文献   
222.
活性污泥法水处理过程是一个复杂的生化反应过程,伴随有物理化学反应、生化反应、相变过程及物质与能量的转化和传递过程.通过对微生物动力学方程的讨论,进而建立动力学模型,比较了Monod方程和Contois方程分别来模拟有机碳在曝气条件下的生化去除过程.模型主要预测底物浓度、溶解氧、微生物增长等引起的系统响应,为污水处理厂的运行提供指导.  相似文献   
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Environmental Chemistry Letters - Humic acids are complex mixtures of organic molecules of different sizes, molecular weights and functional groups such as phenols, carboxyls, quinones and amino...  相似文献   
226.
垂直面绿化植物遮阳系数与叶面积指数研究   总被引:6,自引:0,他引:6  
比较、分析了农业研究中提出的叶面积指数LAI与用于建筑节能领域的垂直面绿化植物叶片遮阳系数SCPVW两个概念的异同和各自的应用范围。指出城市绿化采用水平或垂直绿化方式时,由于下垫面差异,植物叶片的遮阳系数应当分别采用LAI和SCPVW进行计算。  相似文献   
227.
The study on the performance of a fluorinated polyaniline (PANI) as a fiber coating for solid-phase microextraction (SPME) had been reported and 16 polycyclic aromatic hydrocarbons (PAHs) were selected to evaluate the performance of this fiber. Various parameters including sample volume, extraction temperature, time of desorption and extraction, pH and ionic strength were investigated intensively. A direct comparison between PANI-SPME fiber and commercial fiber was conducted. The results showed that the PANI-SPME coating had high affinity towards target compounds and the proposed method was successfully applied for the detection of real samples: rainfall and Taihu Lake water collected from Southern China. The whole PANI-SPME-GC method offers acceptable accuracy, precision and sensitivity and low detection limits, which is applicable to monitor trace levels of PAHs in real water bodies.  相似文献   
228.
建立了水杨酸-次氯酸钠法分析氨的标准曲线,通过对西安市某垃圾填埋场的实地监测,探索了恶臭气体中氨气的分析方法。分析了臭气、氨气、硫化氢之间的浓度相关性,利用本次监测数据,找出了针对该垃圾处理场的高浓度氨气样品初步分析方案。恶臭产生的主要点位为垃圾场渗滤液污水处理站及下游区域,垃圾场臭气呈现出由点源污染(作业面)到面源污染扩散的态势。  相似文献   
229.
浅谈环境监测社会化的质量监管新思路   总被引:1,自引:0,他引:1  
分析了现阶段社会环境检测市场的发展现状及存在的问题,探讨了从环境检测上岗能力、专业技能再教育、从业履历和信用等方面对社会环境检测从业人员进行管理的必要性,提出在机构环境监测能力、检测人员结构流动性、仪器设备在用状态和更新频率、从事环境监测业务信用等方面建立评估机制,推动环境监测市场健康发展。  相似文献   
230.
The degree at which tropical forests are exposed to human pressure is spatially dependent. Population density, proximity to roads, terrain slope, logging activities and land distribution projects are well known factors inducing deforestation and forest degradation in Latin America. Using expert knowledge to weight these threat factors and a Geographical Information System for spatial modeling, a multi-criteria analysis procedure is presented, that allows stratifying a study region in categories of deforestation threat. The procedure was implemented in the Central Volcanic Mountain Range Conservation Area (CVMRCA) in Costa Rica with the purpose of finding areas with a combination of physical and socioeconomic characteristics that is particularly predisposing to a high probability of deforestation. To validate the map, the CVMRCA was stratified in categories of deforestation risk, and the result was superposed to historical deforestation data of the period 1986–1996. The good correlation between risk category and historical deforestation (r = 0.91, p < 0.001) indicates that the map can be used as a decision support tool for defining priority areas for conservation action.  相似文献   
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