[gmx-users] Re: switching off electrostatics

[Vitaly Chaban]

> Hello,
>
> I am a hydrocarbon system consisting of a polyethylene and alkane ( only H

Are you a hydrocarbon system? :-)

> and C). I wanted to know how I Can switch off electrostatic term in mdp
> file. When I delete coulombtype from mdp grompp gives an error:
> when using cutoff r coulomb  must be greatrer than rlist?

Type ZERO charges in topology.


Vitaly