Multiscale modelling approaches for assessing cosmetic ingredients safety

摘要: The European Union’s ban on animal testing for cosmetic ingredients and products has generated a strong momentum the development of in silico vitro alternative methods. One focus COSMOS project was ab initio prediction kinetics toxic effects through multiscale pharmacokinetic modeling data integration. In our experience, mathematical or computer experiments are complementary. We present here summary main models results obtained within framework these topics. A first section presents work at organelle cellular level. then go toward cell levels (monitored continuously), physiologically based effect models, route to extrapolation. follow with short presentation automated KNIME workflows developed dissemination easy use models. end discussion two challenges field: limited ability deal massive complex computations.