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Updated: May 21, 2025

In Silico Modeling Method for Computational Aquatic Toxicology of Endocrine Disruptors: A Software-Based Approach Using QSAR Toolbox
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从最佳可用的物理化学参数减少不确定性的策略 用于模拟跨多媒体环境的新型有机酸盐

Changyue Xing1,2, Jianxin Ge1,2, Rongcan Chen1,2

  • 1School of Environmental Science and Engineering, Shanghai Jiao Tong University, Shanghai 200240, China.

Environmental science & technology
|March 19, 2025
PubMed
概括

预测新型有机酸盐 (OPEs) 的物理化学性质对于环境风险评估至关重要. 本研究确定了最佳的in silico工具和策略,以提高这些必要的环境命运预测的准确性.

关键词:
环境多媒体发行和分发.新型的有机酸 Ester 是一种新型的有机酸 Ester.氧醇空气分区系数 (Koa)八醇 - 水分区系数 (Kow)整体持久性 总体持久性物理化学特性 物理化学特性蒸汽压力 (Vp) 是指蒸汽的压力.在水中溶解度 (Sw)

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