Ammm:Mm aplus

Introduction

One is recommended to read through and understand the background knowledge of polarizable force field AMOEBA, in order to have a better learning experience of the next generation AMOEBA+ force field. As indicated by the name, AMOEBA+ is based on the AMOEBA model with several incoporation of essential physical effects that are missing. Briefly, AMOEBA+ functional form has been designed by following the intermolecular interaction theory described by SAPT (Symmetry Adapted Perturbation Theory).

Charge penetration

http://pubs.acs.org/doi/abs/10.1021/acs.jctc.5b00267