About the Authors

B. Scott Perrin Jr

Affiliation Laboratory of Computational Biology, National Heart, Lung, and Blood Institute, National Institutes of Health, Bethesda, Maryland, United States of America

Benjamin T. Miller

Affiliation Laboratory of Computational Biology, National Heart, Lung, and Blood Institute, National Institutes of Health, Bethesda, Maryland, United States of America

Vinushka Schalk

Affiliation Department of Natural Sciences, New College of Florida, Sarasota, Florida, United States of America

H. Lee Woodcock

Affiliation Department of Chemistry, University of South Florida, Tampa, Florida, United States of America

Bernard R. Brooks

Affiliation Laboratory of Computational Biology, National Heart, Lung, and Blood Institute, National Institutes of Health, Bethesda, Maryland, United States of America

Toshiko Ichiye

ti9@georgetown.edu

Affiliation Department of Chemistry, Georgetown University, Washington, D.C., United States of America

Competing Interests

The authors have declared that no competing interests exist.