Dr. Aniket Magarkar
Post-doc
Dr. Aniket Magarkar
Post-doc – Computational Chemistry
PhD , Centre for Drug Research, University of Helsinki (Finland)
Master in Bioinformatics, University of Pune (India)
Project
Development of a computational tool based on the scientific and technological advances in recent years around molecular dynamics simulation technology, Markov-State-Models, and adaptive learning to elucidate the potential of these technologies to support fragment-based drug discovery approach on highly attractive targets that are precluded by current technological limitations.
Supervisor
Dr. Daniel Seeliger
Research Scientist, Computational Chemistry
PhD in Computational Biophysics, Max-Planck-Institute for Biophysical Chemistry (Germany)
Diploma in Chemistry, University of Ulm
Research interests:
- Application and development of simulation-based technologies for drug discovery
- Computer-aided design of proteins and small molecules
- Development of machine learning applications for small-molecule design