ToxiVerse (Toxicology Universe) is an open-source, comprehensive platform for bioprofiling, curated toxicological datasets, quantitative structure-activity relationship (QSAR) modeling, and chemical data analysis.
The platform has three main modules: Assay Profiler (PubChem bioactivity-based profiling), Database (curated toxicity datasets with sources; currently ~50,000 chemicals), and the Cheminformatics module (curation, PCA, QSAR model building, and prediction).
The Zhu Lab develops cheminformatics algorithms, workflows, and computational tools to model chemical toxicity, ADME (Absorption, Distribution, Metabolism, and Excretion), and other biological activities, supporting regulatory toxicity assessment and computer-aided drug discovery (CADD).
For questions or general inquiries, email toxiverse.help@gmail.com.