Prof. Kirchmair has been appointed Visiting Professor at the University of Vienna, Department of Pharmacy. In the summer semester of 2018 he will be giving lectures in pharmacoinformatics and medicinal chemistry.
False-positive assay signals triggered by badly behaving compounds continue to pose a major challenge to experimental screening. A free web service developed by scientists of the Kirchmair lab, called Hit Dexter, is able to identify such...
Three-dimensional approaches in computer-aided molecular design such as ligand docking, pharmacophore modeling and 3D QSAR rely on the accurate representation of the protein- bound conformations of small molecules. A common approach to...
X-ray crystallography is the backbone of modern, structure-based molecular drug design. While protein structures are easily accessible via the PDB and frequently used, it is to our experience not common practice to inspect the original...
