papers
Publications (3)
physics.comp-ph2018
Formalizing Atom-typing and the Dissemination of Force Fields with Foyer
Christoph Klein, Andrew Z. Summers, Matthew W. Thompson +5
physics.chem-ph2015
Development of a coarse-grained water forcefield via multistate iterative Boltzmann inversion
Timothy C. Moore, Christopher R. Iacovella, Clare McCabe
cond-mat.soft2014
Derivation of coarse-grained potentials via multistate iterative Boltzmann inversion
Timothy C. Moore, Christopher R. Iacovella, Clare McCabe