ChemBioSim: Enhancing Conformal Prediction of In Vivo Toxicity by Use of Predicted Bioactivities.
Marina Garcia de LomanaAndrea MorgerUlf NorinderRoland BuesenRobert LandsiedelAndrea VolkamerJohannes KirchmairMiriam MatheaPublished in: J. Chem. Inf. Model. (2021)