摘要
根据国内外研究报道,系统地总结了计算毒理学和化合物环境行为模拟在环境科学领域的研究进展,包括二者的概念、理论、研究方法以及在环境研究中的应用;分析了计算毒理学和化合物环境行为模拟在发展中所面临的挑战,并提出对策;展望了计算毒理学和化合物环境行为模拟在环境研究中的发展前景。
In light of published studies,we systematically reviewed the advances of computational toxicology and environmental behavior modeling in environmental research,including their concepts,theories,study methods,and applications. In addition,we analyzed the challenges during the development of computational toxicology and environmental behavior modeling,and proposed corresponding solutions. In the end,the developmental prospect of computational toxicology and environmental behavior modeling was positively anticipated.
出处
《环境监控与预警》
2016年第2期1-8,15,共9页
Environmental Monitoring and Forewarning
基金
国家自然科学基金资助项目(41372358)
关键词
计算毒理学
环境行为模拟
环境污染物
计算化学
逸度模型
Computational toxicology
Environmental behavior modeling
Environmental pollutants
Computational chemistry
Fugacity model
