Bemerkung |
Registrations by e-mail to: stefanie.pilhofer@uni-saarland.de
Description:
Introductory seminar on computer-aided drug design, including structure- and ligand-based methods. After a brief introduction, students will be aible to select a topic from the presented drug development pipeline and independently acquire knowledge on the selected topics in the context of structural bio- and cheminformatics. Topics will include homology modeling, target assessment, molecular docking, virtual screening, molecular fingerprints, chemical similarity, ADMET predictions and QSAR; especially with increased focus on ML and DL methods. Under guidance, material ( papers, data and algorithms ) will be collected by each student and presented at the end of the seminar, including the implementation of an application of the individual topics. |