About the Authors

Spencer J. Mitchell

Roles Conceptualization, Data curation, Formal analysis, Investigation, Methodology, Software, Visualization, Writing – original draft

Affiliation Department of Computer Science, Dartmouth, Hanover, New Hampshire, United States of America

Deeptak Verma

Roles Conceptualization, Methodology, Writing – review & editing

Affiliation Computational and Structural Chemistry, Merck & Co., Inc., Kenilworth, New Jersey, United States of America

Karl E. Griswold

Roles Conceptualization, Funding acquisition, Investigation, Writing – review & editing

Affiliations Thayer School of Engineering, Dartmouth, Hanover, New Hampshire, United States of America, Lyticon LLC, Lebanon, New Hampshire, United States of America

Chris Bailey-Kellogg

Roles Conceptualization, Formal analysis, Funding acquisition, Investigation, Methodology, Software, Supervision, Visualization, Writing – original draft

cbk@cs.dartmouth.edu

Affiliations Department of Computer Science, Dartmouth, Hanover, New Hampshire, United States of America, Lyticon LLC, Lebanon, New Hampshire, United States of America

Competing Interests

I have read the journal’s policy and the authors of this manuscript have the following competing interests: KEG and CB-K are member-managers of Lyticon LLC. No other authors have a conflict of interest. Potential conflicts of interest for KEG and CB-K are under management at Dartmouth. The authors declare that the work presented here is free of any bias.