About the Authors

Harald Lanig

Affiliation Computer-Chemie-Centrum der Friedrich-Alexander-Universität Erlangen-Nürnberg, Nägelsbachstraße 25, 91052, Erlangen, Germany

Felix Reisen

Affiliation ETH Zürich, Institute of Pharmaceutical Sciences, Wolfgang-Pauli-Straße 10, 8093, Zürich, Switzerland

David Whitley

Affiliation Centre for Molecular Design, School of Pharmacy and Biomolecular Sciences, University of Portsmouth, King Henry Building, Portsmouth, PO1 2DY, United Kingdom

Gisbert Schneider

Affiliation ETH Zürich, Institute of Pharmaceutical Sciences, Wolfgang-Pauli-Straße 10, 8093, Zürich, Switzerland

Lee Banting

Lee.Banting@port.ac.uk (LB); Tim.Clark@fau.de (TC)

Affiliation School of Pharmacy and Biomolecular Sciences, University of Portsmouth, St. Michael’s Building, White Swan Road, Portsmouth, PO1 2DT, United Kingdom

Timothy Clark

Lee.Banting@port.ac.uk (LB); Tim.Clark@fau.de (TC)

Affiliations Computer-Chemie-Centrum der Friedrich-Alexander-Universität Erlangen-Nürnberg, Nägelsbachstraße 25, 91052, Erlangen, Germany, Centre for Molecular Design, School of Pharmacy and Biomolecular Sciences, University of Portsmouth, King Henry Building, Portsmouth, PO1 2DY, United Kingdom

Competing Interests

The authors have declared that no competing interests exist.

Author Contributions

Conceived and designed the experiments: LB TC. Performed the experiments: HL FR. Analyzed the data: DW. Contributed reagents/materials/analysis tools: DW. Wrote the paper: HL GS LB TC.