Modelling the toxicity of a large set of metal and metal oxide nanoparticles using the OCHEM platform.

Author(s):
Kovalishyn, V.; Abramenko, N.; Kopernyk, I.; Charochkina, L.; Metelytsia, L.; Tetko, I.V.; Peijnenburg, W.J.G.M. (0000-0003-2958-9149); Kustov, L.
Published
2018
Publication type
Article / Letter to editor

Abstract

= 0.58-0.80 for regression models and balanced accuracies of 65-88% for classification models. These results matched the predictions for the test sets used to develop the models. The proposed nano-QSPR models and uploaded data are freely available online at http://ochem.eu/article/103451 and can be used for estimation of toxicity of new and emerging nanoparticles at the early stages of nanomaterial development.

Date issued
2018-02-28
Language
English
Is part of
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association (2018), Vol. 112, p. 507-517
hdl
1887/81898
doi
10.1016/j.fct.2017.08.008