[ghemical-devel] Charged species in Ghemical

[Tommi Hassinen]

On Mon, 17 Jul 2006, Rzepa, Henry wrote:

> The 2.02 GUI does not appear to have any mechanism for specifying charged
> atoms.
>
> In particular,  I am wondering whether the force field supports eg
> alkoxide (O-)  or carbocation  (R3C+)

Hello,

there is no such support yet. I'm planning to add it later, but it's not 
going to be usable in near future (12-18 months).

Regards,

 	Tommi