1. School of Pharmacy, University of Eastern Finland, Kuopio FI-70211, Finland
2. CSC─IT Center for Science Ltd., Espoo FI-02101, Finland
3. Computational Medicine Design, Orion Pharma, Orionintie 1A, Espoo FI-02101, Finland
4. Department of Pharmaceutical and Medicinal Chemistry, Institute of Pharmaceutical Sciences, Eberhard Karls University, Tübingen DE-72076, Germany
5. Cluster of Excellence iFIT (EXC 2180) “Image-Guided and Functionally Instructed Tumor Therapies”, University of Tübingen, Tübingen DE-72076, Germany
6. Tübingen Center for Academic Drug Discovery & Development (TüCAD2), Tübingen DE-72076, Germany