Category:
Theoretical and Computational Chemistry
, Title:
Open Force Field BespokeFit: Automating Bespoke Torsion Parametrization At Scale
, Authors:
Joshua Horton, Simon Boothroyd, Jeffrey Wagner, Joshua Mitchell, Trevor Gokey, David Dotson, Pavan Behara, Venkata Ramaswamy, Mark Mackey, John Chodera, Jamshed Anwar, David Mobley, Daniel Cole