2000•China Environmental ScienceRequires access
QSAR research of chlorinated aromatic compounds toxicity to Selenastrum capricornutum.
Aiqian Zhang
Open publisher page 0 citations
Abstract
The acute toxicities of 16 chlorinated aromatic compounds to Selenastrum capricornutum were determined; and the relationships between their chemical structures and activity were investigated based on quantum chemical descriptors. Furthermore, it was proved by using Leave-One-Out tests that the prediction model was stable. It could be concluded that TE was the key parameter in determining the toxicity of this group of compounds to Selenastrum capricornutum; and the key steps included transformation process and biocheatal reaction.