Broad and comprehensive set of theoretical lectures and practical tutorials in the areas of structural bioinformatics and drug design for the master students of Freie University Berlin. The course begins with a general introduction of the drug design pipeline and an introductory course on the structural bioinformatics research field. I am involved in more specialized topics, amongst others in cheminformatics, natural product based drug discovery and more detailed aspects of toxicity prediction models. Lecture info at FU website : Lectureship
Emanuel Kemmler- Food Allergy (KFO) funded by DFG, PhD thesis (2021- present)
Frederic Denhbostel - Natural Products chemical descriptors, Master thesis (Bioinformatics), Freie Universitaet Berlin, 2024
Thimo Welner - Explainable AI in Neurotoxicity prediction, Master thesis (Bioinformatics), Freie Universitaet Berlin, 2024
Masoumeh Vojood- Data-driven- analysis and development of computational nephrotoxicity model for the prediction of small molecules Master thesis (Bioinformatics) University of Potsdam, 2024
Alena Rzaeva: Explainable AI in chemical toxicity prediction, Master thesis (Bioinformatics), Freie Universitaet Berlin, 2023
Daniel Steiert: ProteinLigandHunter- identification of novel drug repurposing opportunities by integrating protein chemistry and protein similarity, Master Thesis (Bioinformatics), Freie Universitaet Berlin, 2022
Wang- JU- Network-based Analysis of Gene-Protein-Chemical (drugs)involved in Polycystic Ovarian Syndrome (PCOS) Master thesis (Bioinformatics), Freie Universitaet Berlin, 2022
Christina Kirschbaum: Machine Learning models for the prediction of off-target activities, Bachelor Thesis, Freie Universitaet Berlin, 2021
Finnja Becker: Virtual Screening of COVID-19 Main Protease to Identify Potential Inhibitors Using SuperNatural II Database, Bachelor Thesis (Bioinformatics), Freie Universitaet Berlin, 2021
Julian Bunzel- Analysis of molecular target-chemical space of liver toxicity- Master thesis (Bioinformatics), University of Potsdam (2021)
Frederic Dehnbostel -Computational prediction of blood-brain-barrier permeability-Bachelor thesis, Freie Universitaet Berlin (2021)
Alena Rzaeva -Computational prediction of chemical induced T-cell toxicity -Bachelor thesis, Freie Universitaet Berlin, 2021
Emanuel Kemmler - Analysis of CAZymes among halophilic Archaea with Multivariate Statistics and Network Analysis - Master thesis (Bioinformatics), second Supervisor, Freie Universitaet Berlin, 2021
Pon Ganish Prakash -Exhaustive analysis of toxic substructures in chemical data sets- Master thesis (Bioinformatics),Freie Universitaet Berlin, 2020
Nils Wachsmann - Computational prediction of chemical induced nephrotoxicity -Bachelor thesis, Freie Universitaet Berlin, 2020
Renata Abel -Computational prediction of the therapeutic potential of natural products based on Super Natural II database - Visiting researcher, Wroclaw Medical Univeristy, Poland, 2020
Moritz Grahl - Development of novel in silico method for the prediction of biosynthetic pathways -Master thesis, Freie Universitaet Berlin, 2020
Rascha Basaleh - Prediction and Analysis of Drugs Induced Liver Injury using ProTox-II Computational Tool - Bachelor thesis (Bioinformatics), Freie Universitaet Berlin, 2019
Seyma Boz - Classification of the toxicity profile of the withdrawn drugs using computational prediction platform ProTox-II- Bachelor thesis (Bioinformatics), Freie Universitaet Berlin, 2019
Vinoth Mohanakrishnan - Validation and Graphical User Interface Design of OPAS- Master thesis (Bioinformatics), Freie Universitaet Berlin, 2017
Julian Bunzel - Analysis of molecular target-chemical space of DILI drugs- Bachelor thesis (Bioinformatics), Freie Universitaet Berlin, 2017
Ebru Shn - Literature based mining of drug induced liver injury data-Bachelor Thesis (Bioinformatics), Freie Universitaet Berlin, 2016
Franziska Fritz -Development of supersweet database- Bachelor Thesis (Bioinformatics), Freie Universitaet Berlin, 2016
Fred Prackwieser - Machine learning models for prediction of Cytochrome P450 substrate -Bachelor Thesis (Bioinformatics), Freie Universitaet Berlin, 2016