ELECTRONIC SUPPLEMENTARY INFORMATION OF
Aquatic Ecotoxicity of Personal Care Products: QSAR models and ranking for prioritization and
safer alternatives’ design
Paola Gramatica*, Stefano Cassani and Alessandro Sangion
QSAR Research Unit in Environmental Chemistry and Ecotoxicology, Department of Theoretical and
Applied Sciences, University of Insubria, Varese, Italy
E-mail: paola.gramatica@uninsubria.it; http://www.qsar.it ; Tel: +39-0332-421573
Model graphs and equations for Pseudokirchneriella subcapitata toxicity
- Random splitting
Figure ES1: Graph of experimental vs. predicted values (on the left) and Williams Plot (on the right) for
the P.subcapitata PCP split by random model.
pEC50 P.subcapitata = -9.50 + 20.55 Mp + 12.36 GGI8
- Ordered by response splitting
Graphs in the main text
pEC50 P.subcapitata = -10.60 + 14.05 GGI8 + 21.83 Mp
Electronic Supplementary Material (ESI) for Green Chemistry.
This journal is © The Royal Society of Chemistry 2016