QSPR prediction of chromatographic retention times of pesticides: Partition and fractal indices

The high‐performance liquid‐chromatographic retentions of red‐wine pesticide residues are modeled by structure–property relationships. The effect of different types of features is analyzed: geometric, lipophilic, etc. The properties are fractal dimensions, partition coefficient, etc., in linear and nonlinear correlation models. Biological plastic evolution is an evolutionary perspective conjugating the effect of acquired characters and relations that emerge among the principles of evolutionary indeterminacy, morphological determination and natural selection. It is applied to design the co‐ordination index that is used to characterize pesticide retentions. The parameters used to calculate the co‐ordination index are the molar formation enthalpy, molecular weight and surface area. The morphological and co‐ordination indices barely improve the correlations. The fractal dimension averaged for non?buried atoms, partition coefficient, etc. distinguishes the pesticide molecular structures. The structural and constituent classification is based on nonplanarity, and the number of cycles, and O, S, N and Cl atoms. Different behavior depends on the number of cycles.     

辽宁省沿海经济带经济与环境协调度时空演变研究

协调度理论已成为衡量区域经济增长与环境保护协调发展的重要理论。在阐述其理论的基础上,选取了经济与环境方面的评价指标、计算方法和模型。通过对辽宁省沿海经济带及其6市2000年、2002年、2004年、2006年、2008年、2009年的17项指标进行技术处理和分析,对经济带各市的经济与环境协调发展度进行了时空演变研究。结果表明,经济带及其6市10年间协调发展度在时间维度上呈现逐年上升,其类型由中度失调衰退型和濒临失调衰退型逐渐向中级协调发展型和高级协调发展型演变;经济带经济环境协调发展度整体水平逐年升高;经济带的经济综合实力f（x）和环境承载力g（y）差距不大,经济发展与环境保护基本保持同步,在环境承载力范围内经济综合实力有进一步发展的空间。     

Detection of early effects of a single herbicide (diuron) and a mix of herbicides and pharmaceuticals (diuron, isoproturon, ibuprofen) on immunological parameters of Pacific oyster (Crassostrea gigas) spat

In the context of massive summer mortality events of the Pacific oyster Crassostrea gigas, the aim of this study was to investigate the early effects on genes, enzymes and haemocyte parameters implicated in immune defence mechanisms in C. gigas oysters exposed to a potentially hostile environment, i.e. to an herbicide alone or within a mixture. Following 2 h of exposure to the herbicide diuron at 1 μg L⁻¹, the repression of different genes implicated in immune defence mechanisms in the haemocytes and the inhibition of enzyme activities, such as laccase-type phenoloxidase (PO) in the plasma, were observed. The inhibition of superoxide dismutase (SOD) activity in the plasma was also observed after 6 and 24 h of exposure. In the mixture with the herbicides diuron and isoproturon, and the pharmaceutical ibuprofen, catecholase-type PO activity in the plasma and the percentage of phagocytosis in the haemocytes were reduced after 6 h of exposure. Our results showed that early effects on molecular, biochemical and cellular parameters can be detected in the presence of diuron alone or within a mixture, giving an insight of its potential effect in situations that can be found in natural environments, i.e. relatively high concentrations for short periods of time.     

Histopathological biomarkers in gills and liver of Oreochromis niloticus from polluted wetland environments, Saudi Arabia

Fish live in direct contact with their immediate external environment and, therefore, are highly vulnerable to aquatic pollutants. In this study, Oreochromis niloticus were caught at three different sites in Al-Hassa irrigation channels, namely Al-Jawhariya, Um-Sabah and Al-Khadoud. The histological changes in gills and liver were detected microscopically and evaluated with semi-quantitative analyses. Also, heavy metals have been determined in the water samples in these sites. Results showed that all sites were polluted by different kinds of heavy metals. Cd and Pb were mostly detected at concentrations above the WHO reference values. Meanwhile, various histopathological abnormalities were observed in gills and liver of fish specimens. In the gill filaments, cell proliferation, lamellar cell hyperplasia, lamellar fusion, lifting of the respiratory epithelium, and the presence of aneurysmal areas were observed. In the liver, there was vacuolization of the hepatocytes, sinusoidal congestion, necrosis of the parenchyma tissue, nuclear pyknosis, eosinophilic hepatocellular degeneration, pigment accumulation, an increase in the number and size of melanomacrophage centers. Liver tumors with severe chronic inflammation were occasionally found in fish at Al-Khadoud area (first-time report). The histological lesions were comparatively most severe in the liver. Despite heavy metals assessment did not show marked differences among sites, histopathological biomarkers indicated that the surveyed fish are living under stressful environmental conditions. So, we suggest use those biomarkers in future monitoring of aquatic systems.     

Ambient nitrogen oxides exposure and early childhood respiratory illnesses

Acute respiratory infections are common in children below 5 years and recent studies suggest a possible link with air pollution. In this study, we investigated the association between ambient nitrogen oxides (NO_x) and bronchitis or upper airway inflammation.This longitudinal study was conducted in Teplice and Prachatice districts, Czech Republic. Children were followed from birth to 4.5 years of age. Data were compiled from medical records at delivery and at follow up, and from self-administered questionnaires from the same two time points. Air pollution monitoring data were used to estimate exposure over five different averaging periods ranging from three to 45 days prior to an episode. To quantify the association between exposure and outcome, while accounting for repeated measure correlation we conducted logistic regression analysis using generalized estimating equations.During the first 2 years of life, the adjusted rate ratio for bronchitis associated with interquartile increase in the 30-day average NO_x was 1.31 [95% confidence interval (CI): 1.07, 1.61] and for two to 4.5 year olds, it was 1.23 (95% CI: 1.01, 1.49). The 14-day exposure also had stable association across both age groups: below 2 years it was 1.25 (95% CI: 1.06, 1.47) and for two to 4.5 years it was 1.21 (95% CI: 1.06, 1.39). The association between bronchitis and NO_x increased with child's age in the under 2 years group, which is a relatively novel finding.The results demonstrate an association between NO_x and respiratory infections that are sufficiently severe to come to medical attention. The evidence, if causal, can be of public health concern because acute respiratory illnesses are common in preschool children.     

Ecosystem engineering potential of the gastropod Terebralia palustris (Linnaeus, 1767) in mangrove wastewater wetlands - A controlled mesocosm experiment

The effect of different sewage concentrations (0, 20, 60 and 100%), vegetation (Bare, Avicennia marina or Rhizophora mucronata) and immersion periods (immersion/emersion period of 12/12 h or 3/3 days just for 100%) conditions were studied for 6 months on survival and growth rates of Terebralia palustris (Linnaeus, 1767). Gastropods' activity and ecosystem engineering preformed at bare and A. marina planted cells and 3 sewage conditions (0, 20 and 60%) were determined. Survival rates were higher than 70% in all treatments. Growth rate decreased significantly with increasing sewage concentrations (mainly at unplanted conditions) and longer immersion periods. A complete shift (from immersion to emersion periods) and a significant decrease in mobility and consequently its engineer potential, due to sewage contamination, lead to a 3-4 fold decrease in the amount of sediment disturbed. Sewage contamination, primary producers' abundance and environmental conditions may have influenced the gastropods survival, growth and its ecosystem engineering potential.     

1949年以来中国环境与发展关系的演变

从IPAT方程出发,发现了环境影响随着经济发展或时间的演变依次遵循三个"倒U型"曲线规律,即环境影响强度的倒U型曲线、人均环境影响的倒U型曲线和环境影响总量的倒U型曲线。根据此规律,可以将该演化过程划分为四个阶段即:环境影响强度高峰前阶段、环境影响强度高峰到人均环境影响量高峰阶段、人均环境影响量高峰到环境影响总量高峰阶段以及环境影响总量稳定下降阶段。在环境演变的不同阶段,主要驱动力存在着明显的差异。在环境影响强度高峰前阶段,资源消耗或污染物排放增长更多地由资源或污染密集型技术进步驱动;在资源消耗或污染物强度高峰到人均资源消耗或污染物排放高峰阶段,主要由经济增长驱动;而在人均资源消耗或污染物排放高峰到资源消耗或污染物排放总量高峰阶段以及总量高峰以后的发展阶段,则主要由节约高效技术或污染减排技术进步来驱动。实证分析表明,中国目前环境与发展关系基本上处于经济增长主要驱动的环境影响强度高峰向人均环境影响高峰过渡阶段,这同时意味着中国要在短期内实现人均环境影响和环境影响总量高峰的跨越是异常困难的。     

常熟市耕地资源时空演变特征

基于卫星遥感影像数据,GIS空间分析技术和统计分析方法相结合,利用耕地面积缩减强度指数、空间叠加等方法分析了常熟市耕地资源的时空演变特征,揭示了苏南经济发达地区耕地资源减少的规律。研究发现,随着经济发展,常熟耕地资源逐渐减少,且因城区和工业用地扩张引起的耕地非农转化指向十分强烈,居民点空间的指向呈逐渐减弱的态势。从空间演变规律看,常熟耕地非农化主要表现在：1）经济增长越快,发展水平越高,耕地减少越快;2）在城市、港口区的镇耕地减少更快;3）港区和工业区的建设,使其周边耕地非农化速度加快;4）道路交通的扩张是耕地非农转化的一个稳定因素;5）不同时期,耕地非农占用的空间指向不同：从20世纪80年代被居民点用地占用逐渐变迁为2000年以后的被工业用地、城镇用地、港口用地占用为主。城市发展、港区建设、交通建设、农村居民点建设、工业化推进和经济发展是耕地资源缩减的主导影响因子.     

泰州市建设用地扩展规律与格局演化研究

以多时相Landsat、TM/ETM卫星影像为数据源,运用GIS软件提取泰州市建设用地1988～2008年5个时相的用地信息,运用扩展强度指数、扩展速度指数、空间自相关等方法分析泰州市建设用地扩展时空特征和演化规律。结果表明:(1)泰州建设用地扩展经历了缓慢扩展、中速扩展、缓慢扩展3个阶段,显示了建设用地逐步走向集约利用的趋势;(2)在分析泰州建设用地不同扩展阶段的基础上,发现泰州建设用地扩展模式正处于从点状扩展向点轴扩展转变阶段,并出现了网络化扩展的端倪;(3)运用空间自相关分析了泰州建设用地扩展热点演化过程,发现扩展热点呈现跳跃迁移的特征,热点区与冷点区出现交替演化,Moran散点图体现了泰州市建设用地扩展处于空间极化的状态,外围城镇受中心城镇增长极带动发展的扩展模式。