THERESA - a new reaction database-driven tool for stepwise retrosynthetic analysis

Por Schwab, Christof H, Bienfait, B, Gasteiger, J
Publicado no Chem Cent J (2008)

The eTOX Data-Sharing Project to Advance in Silico Drug-Induced Toxicity Prediction

Por Cases, Montserrat, Briggs, Katharine, Steger-Hartmann, Thomas, Pognan, François, Marc, Philippe, Kleinöder, Thomas, Schwab, Christof H., Pastor, Manuel, Wichard, Jörg, Sanz, Ferran
Publicado no Int J Mol Sci (2014)

Quantifying intrinsic chemical reactivity of molecular structural features for protein binding and reactive toxicity, using the MOSES chemoinformatics system

Por Schwöbel, Johannes AH, Bienfait, Bruno, Gasteiger, Johann, Kleinöder, Thomas, Marusczyk, Jörg, Sacher, Oliver, Schwab, Christof H, Tarkhov, Aleksey, Terfloth, Lothar, Cronin, Mark TD
Publicado em 2012

Inroads to Predict in Vivo Toxicology—An Introduction to the eTOX Project

Por Briggs, Katharine, Cases, Montserrat, Heard, David J., Pastor, Manuel, Pognan, François, Sanz, Ferran, Schwab, Christof H., Steger-Hartmann, Thomas, Sutter, Andreas, Watson, David K., Wichard, Jörg D.
Publicado em 2012