Article Information
History
- October 27, 2020.
Article Versions
- Version 1 (October 25, 2020 - 04:02).
- Version 2 (October 26, 2020 - 03:19).
- You are currently viewing Version 3 of this article (October 27, 2020 - 13:14).
- View Version 4, 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
- 1Computational and Systems Biology Program, Sloan Kettering Institute, Memorial Sloan Kettering Cancer Center, New York, NY 10065, USA
- 2Tri-Institutional PhD Program in Computational Biology and Medicine, Weill Cornell Graduate School of Medical Sciences, New York, NY 10065, USA
- ↵*For correspondence:
marcus.wieder{at}choderalab.org (MW)
↵∗ contributed equally to this work
Posted October 27, 2020.
Fitting quantum machine learning potentials to experimental free energy data: Predicting tautomer ratios in solution
