一个关于离子液体细胞毒性的综合数据集
Liana A Arakelyan1, Daria M Arkhipova1, Marina M Seitkalieva1
1Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Leninsky Prospekt 47, Moscow, 119991, Russia.
Scientific data
|December 18, 2024
概括
这项研究从众多论文中收集了有关离子液 (IL) 细胞毒性的大量数据. 该数据集有助于理解IL结构如何影响它们对细胞的毒性影响.
科学领域:
- 绿色化学 绿色化学
- 毒理学 毒理学 毒理学
- 材料科学 材料科学 材料科学
背景情况:
- 离子液体 (ILs) 是多功能,可调节的盐,具有广泛的应用.
- ILs的环境和生物毒性带来了重大挑战.
- 了解IL的毒性对于安全的应用和开发至关重要.
研究的目的:
- 创建一个关于离子液体细胞毒性的综合数据集.
- 为了促进对ILs的结构-活性关系 (SAR) 研究.
- 确定影响IL细胞毒性的关键结构特征.
主要方法:
- 从151篇研究论文中汇编了数据.
- 包括1227种独特的离子液体和3837个数据输入.
- 详细的实验参数,如化时间,细胞系和检测.
主要成果:
- 建立了一个大规模的,公开可用的IL细胞毒性数据集.
- 为每个数据输入提供详细信息,包括化学标识符和实验条件.
- 该数据集涵盖了广泛的IL结构及其相应的毒性值.
结论:
- 编制的数据集是研究IL毒性研究的研究人员的宝贵资源.
- 能够进行深入的SAR分析,以预测和减轻IL毒性.
- 促进离子液体在各种领域的更安全的设计和应用.
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