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Criterion of molecular size to evaluate the bioaccumulation potential of chemicals in fish

To evaluate the bioaccumulation potential of chemicals in fish, a molecular-size descriptor, D(max aver), has been used as a weight of evidence under the EU REACH. The D(max aver) value, however, is estimated on the basis of 3-D structures of possible stable conformers in a vacuum using OASIS softwa...

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Detalles Bibliográficos
Autores principales: Miyata, Chiyoko, Matoba, Yoshihide, Mukumoto, Makiko, Nakagawa, Yoshiaki, Miyagawa, Hisashi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Pesticide Science Society of Japan 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8931549/
https://www.ncbi.nlm.nih.gov/pubmed/35414761
http://dx.doi.org/10.1584/jpestics.D21-030