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机译:Construction of an In Silico Structural Profiling Tool Facilitating Mechanistically Grounded Classification of Aquatic Toxicants
School of Pharmacy and Biomolecular Sciences, Liverpool John Moores University, Liverpool L3 3AF, U.K.;
KREATiS SAS, ZAC de St-Hubert 38080 L'Isle d'Abeau, France;
toxicity prediction; aquatic; chemical structure; environmental species; classification; mechanism of action;