Grid-based surface generalized Born model for calculation of electrostatic binding free energies

N Forouzesh, S Izadi, AV Onufriev - Journal of chemical …, 2017 - ACS Publications
Fast and accurate calculation of solvation free energies is central to many applications, such
as rational drug design. In this study, we present a grid-based molecular surface …

Grid-Based Surface Generalized Born Model for Calculation of Electrostatic Binding Free Energies

N Forouzesh, S Izadi… - Journal of chemical …, 2017 - pubmed.ncbi.nlm.nih.gov
Fast and accurate calculation of solvation free energies is central to many applications, such
as rational drug design. In this study, we present a grid-based molecular surface …

Grid-Based Surface Generalized Born Model for Calculation of Electrostatic Binding Free Energies.

N Forouzesh, S Izadi, AV Onufriev - Journal of Chemical Information …, 2017 - europepmc.org
Fast and accurate calculation of solvation free energies is central to many applications, such
as rational drug design. In this study, we present a grid-based molecular surface …