Hi,
In general, run "gmx help tool" to see how the tool should be run, here to
see that there's an option for you to choose a non-default charge
Mark
On Fri, 16 Jun 2017 14:21 Justin Lemkul wrote:
>
>
> On 6/16/17 7:14 AM, Quyen V. Vu wrote:
> > Dear GMX developer,
> > I don't know this mailin
On 6/16/17 7:14 AM, Quyen V. Vu wrote:
Dear GMX developer,
I don't know this mailing list is suitable for posting issue or not, if
not- forgive me.
I want to report about gmx genion module
If i want to add concentration of salt by -conc option, it just correct for
monovalent salt (eg. NACL).
Dear GMX developer,
I don't know this mailing list is suitable for posting issue or not, if
not- forgive me.
I want to report about gmx genion module
If i want to add concentration of salt by -conc option, it just correct for
monovalent salt (eg. NACL).
For multivalent salt(MGCL2), if I use -pna