About the Authors
- Bo-Xue Tian
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Affiliations Department of Pharmaceutical Chemistry, School of Pharmacy, University of California, San Francisco, San Francisco, California, United States of America, California Institute for Quantitative Biomedical Research, University of California, San Francisco, San Francisco, California, United States of America
- Frank H. Wallrapp
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Affiliations Department of Pharmaceutical Chemistry, School of Pharmacy, University of California, San Francisco, San Francisco, California, United States of America, California Institute for Quantitative Biomedical Research, University of California, San Francisco, San Francisco, California, United States of America
- Gemma L. Holiday
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Affiliations California Institute for Quantitative Biomedical Research, University of California, San Francisco, San Francisco, California, United States of America, Department of Bioengineering and Therapeutic Sciences, University of California, San Francisco, San Francisco, California, United States of America
- Jeng-Yeong Chow
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Affiliation Department of Chemistry, University of Utah, Salt Lake City, Utah, United States of America
- Patricia C. Babbitt
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Affiliations California Institute for Quantitative Biomedical Research, University of California, San Francisco, San Francisco, California, United States of America, Department of Bioengineering and Therapeutic Sciences, University of California, San Francisco, San Francisco, California, United States of America
- C. Dale Poulter
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Affiliation Department of Chemistry, University of Utah, Salt Lake City, Utah, United States of America
- Matthew P. Jacobson
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* E-mail: matt.jacobson@ucsf.edu
Affiliations Department of Pharmaceutical Chemistry, School of Pharmacy, University of California, San Francisco, San Francisco, California, United States of America, California Institute for Quantitative Biomedical Research, University of California, San Francisco, San Francisco, California, United States of America
Competing Interests
MPJ is a consultant for Schrödinger LLC, which licenses, develops, and distributes software used in this work. All other authors have declared that no competing interests exist.
Author Contributions
Conceived and designed the experiments: BXT CDP MPJ. Performed the experiments: BXT FHW. Analyzed the data: BXT FHW. Contributed reagents/materials/analysis tools: BXT FHW GLH PCB CDP MPJ. Wrote the paper: BXT FHW GLH JYC PCB CDP MPJ.