About the Authors

Peter Eastman

Roles Conceptualization, Formal analysis, Investigation, Methodology, Software, Writing – original draft, Writing – review & editing

peastman@stanford.edu

Affiliation Department of Bioengineering, Stanford University, Stanford, CA, United States of America

Jade Shi

Roles Conceptualization, Formal analysis, Writing – original draft, Writing – review & editing

Affiliation Department of Chemistry, Stanford University, Stanford, CA, United States of America

Bharath Ramsundar

Roles Conceptualization, Software

Affiliation Department of Computer Science, Stanford University, Stanford, CA, United States of America

Vijay S. Pande

Roles Funding acquisition, Resources, Supervision

Affiliation Department of Bioengineering, Stanford University, Stanford, CA, United States of America

Competing Interests

I have read the journal's policy and the authors of this manuscript have the following competing interests: VSP is an SAB member of Schrodinger, LLC and a General Partner at Andreessen Horowtiz.