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History
- July 13, 2018.
Article Versions
- Version 1 (March 21, 2018 - 15:50).
- Version 2 (June 15, 2018 - 11:45).
- You are viewing Version 3, the most recent version of this article.
Copyright
The copyright holder for this preprint is the author/funder, who has granted bioRxiv a license to display the preprint in perpetuity. It is made available under a CC-BY 4.0 International license.
Author Information
- David L. Mobley1,2,
- Caitlin C. Bannan2,
- Andrea Rizzi3,5,
- Christopher I. Bayly4,
- John D. Chodera5,
- Victoria T. Lim2,
- Nathan M. Lim1,
- Kyle A. Beauchamp6,
- Michael R. Shirts7,
- Michael K. Gilson8 and
- Peter K. Eastman9
- 1Department of Pharmaceutical Science, University of California, Irvine CA 92697
- 2Department of Chemistry, University of California, Irvine CA 92697
- 3Tri-Institutional Program in Computational Biology and Medicine, New York NY 10065
- 4OpenEye Scientific Software, Santa Fe NM 87507
- 5Computational and Systems Biology Program, Memorial Sloan Kettering Cancer Center, New York NY 10065
- 6Counsyl, South San Francisco, CA 94080
- 7Department of Chemical and Biological Engineering, University of Colorado Boulder, Boulder, CO 80309
- 8Skaggs School of Pharmacy and Pharmaceutical Sciences, University of California, San Diego
- 9Department of Chemistry, Stanford University, Stanford, CA 94305
- *For correspondence:
dmobley{at}mobleylab.org (DLM)