[gmx-users] Does shell molecular exclude core shell electrostatics automatically

Hi, all, I was wondering if the shell molecular dynamics exclude the electrostatic interaction automatically. According to the shell model, the interaction between core and shell in replaced by the harmonic interaction. If not, how to exclude electrostatic interaction between them?

Re: [gmx-users] Does shell molecular exclude core shell electrostatics automatically

Shuangxing Dai wrote: Hi, all, I was wondering if the shell molecular dynamics exclude the electrostatic interaction automatically. According to the shell model, the interaction between core and shell in replaced by the harmonic interaction. If not, how to exclude electrostatic