Toxicity Prediction

With the help of toxicity QSAR models, prediction of toxic effects of small molecules can be done. Used QSAR models are developed based on manually-curated large database of molecular interactions, molecular pathways, gene-disease associations, chemical metabolism and toxicity information.

Virtual screening of a large set of small molecules against a specific toxicity (i.e., cardiotoxicity) can also be done.

If you interested these projects, please contact us: