ChemTunes∙ToxGPS®

is a unique chemoinformatics platform to support the safety and risk assessment of chemical substances and provides expert-reviewed toxicity databases as well as a knowledgebase and workflows for MoA-based in silico predictions and read-across for a series of in vivo and in vitro human health and regulatory-relevant toxicity endpoints.

RepDose database from Fraunhofer ITEM available now

CORINA Symphony

is a chemoinformatics application to manage, manipulate and profile molecular datasets for in silico discovery, optimization and modeling experiments with a focus on computational toxicity applications. It combines the unique features of CORINA Classic with powerful structural and physicochemical descriptor calculation and the ChemoTyper approach housing the ToxPrint chemotypes library.

CORINA Classic

is a fast and powerful 3D structure generator for small and medium sized, typically drug-like molecules. Its robustness, comprehensiveness, speed and performance makes it a perfect application to convert large chemical datasets or databases.

Version 4.1.0 available now