In vitro to in vivo extrapolation represents a critical challenge in toxicology. In this paper we explore extrapolation strategies for acetaminophen (APAP) based on mechanistic models, comparing class
Drug-induced liver injury (DILI) is a key safety issue in the drug discovery pipeline and a regulatory concern. Thus, many in silico tools have been proposed to improve the hepatotoxicity prediction o
Pyrrolizidine alkaloids (PAs) are characteristic metabolites of some plant families and form a powerful defence mechanism against herbivores. More than 600 different PAs are known. PAs are ester alkal