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新型毒理学评估方法对绿色化学和化学替代品的影响。

The Impact of Novel Assessment Methodologies in Toxicology on Green Chemistry and Chemical Alternatives.

机构信息

Department of Veterinary Integrative Biosciences, Texas A&M University, College Station, Texas 77843.

Predictive Compound Safety and ADME, AstraZeneca Pharmaceuticals LP, Waltham, Massachusetts 02451.

出版信息

Toxicol Sci. 2018 Feb 1;161(2):276-284. doi: 10.1093/toxsci/kfx196.

Abstract

The field of experimental toxicology is rapidly advancing by incorporating novel techniques and methods that provide a much more granular view into the mechanisms of potential adverse effects of chemical exposures on human health. The data from various in vitro assays and computational models are useful not only for increasing confidence in hazard and risk decisions, but also are enabling better, faster and cheaper assessment of a greater number of compounds, mixtures, and complex products. This is of special value to the field of green chemistry where design of new materials or alternative uses of existing ones is driven, at least in part, by considerations of safety. This article reviews the state of the science and decision-making in scenarios when little to no data may be available to draw conclusions about which choice in green chemistry is "safer." It is clear that there is no "one size fits all" solution and multiple data streams need to be weighed in making a decision. Moreover, the overall level of familiarity of the decision-makers and scientists alike with new assessment methodologies, their validity, value and limitations is evolving. Thus, while the "impact" of the new developments in toxicology on the field of green chemistry is great already, it is premature to conclude that the data from new assessment methodologies have been widely accepted yet.

摘要

实验毒理学领域正在通过采用新的技术和方法快速发展,这些方法为化学暴露对人类健康的潜在不良影响机制提供了更精细的观察视角。来自各种体外分析和计算模型的数据不仅有助于提高危害和风险决策的可信度,而且还能够更好、更快、更便宜地评估更多的化合物、混合物和复杂产品。这对于绿色化学领域特别有价值,因为新材料的设计或现有材料的替代用途至少部分是由安全性考虑驱动的。本文综述了当几乎没有数据可用于得出关于绿色化学中哪种选择“更安全”的结论时的科学和决策现状。很明显,没有“一刀切”的解决方案,需要权衡多个数据流来做出决策。此外,决策者和科学家对新评估方法的整体熟悉程度、它们的有效性、价值和局限性都在不断发展。因此,尽管毒理学新发展对绿色化学领域的“影响”已经很大,但现在就得出新评估方法的数据已经被广泛接受的结论还为时过早。

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A practical guidance for Cramer class determination.关于克莱默类别确定的实用指南。
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