About the Authors

Gerard J. P. van Westen

Affiliation Division of Medicinal Chemistry, Leiden/Amsterdam Center for Drug Research, Leiden, The Netherlands

Jörg K. Wegner

Affiliation Tibotec BVBA, Beerse, Belgium

Peggy Geluykens

Affiliation Tibotec BVBA, Beerse, Belgium

Leen Kwanten

Affiliation Tibotec BVBA, Beerse, Belgium

Inge Vereycken

Affiliation Tibotec BVBA, Beerse, Belgium

Anik Peeters

Affiliation Tibotec BVBA, Beerse, Belgium

Adriaan P. IJzerman

Affiliation Division of Medicinal Chemistry, Leiden/Amsterdam Center for Drug Research, Leiden, The Netherlands

Herman W. T. van Vlijmen

Affiliations Division of Medicinal Chemistry, Leiden/Amsterdam Center for Drug Research, Leiden, The Netherlands, Tibotec BVBA, Beerse, Belgium

Andreas Bender

ab454@cam.ac.uk

Affiliations Division of Medicinal Chemistry, Leiden/Amsterdam Center for Drug Research, Leiden, The Netherlands, Unilever Centre for Molecular Science Informatics, University of Cambridge, Cambridge, United Kingdom

Competing Interests

The authors have read the journal's policy and have the following conflicts: The Non-Nucleoside Reverse Transcriptase Inhibitiros Etravirine and Rilpivirine are marketed drugs developed by Tibotec, one of the funders of the current study. GJPvW was funded by Tibotec BVBA and JKW, PG, LK, IV, AP and HWTvV are employees of this company. There are no patents, products in development or marketed products to declare. This does not alter the authors' adherence to all the PLoS ONE policies on sharing data and materials, as detailed online in the guide for authors.

Author Contributions

Conceived and designed the experiments: GJPvW JKW API HWTvV AB. Performed the experiments: GJPvW PG LK IV AP. Analyzed the data: GJPvW JKW HWTvV AB. Contributed reagents/materials/analysis tools: GJPvW JKW PG LK IV AP API HWTvV AB. Wrote the paper: GJPvW JKW API HWTvV AB.