ligand are default groups and do not require the use of an
> index file. If the ligand isn't showing up in the list, it's probably
> because
> you're supplying an index file from which the ligand group has been
> deleted.
>
> -Justin
>
> --
>
On 8/4/17 4:57 AM, G R wrote:
Dear users,
I try to implement Clayff forcefield for Kaolinite. I created my force
field (I'm not sure about it), but gromacs couldn't find my force field in
the directory. Here is my forcefield.
ffnonbonded
[ atomtypes ]
; name mass chargeptype
Dear users,
I try to implement Clayff forcefield for Kaolinite. I created my force
field (I'm not sure about it), but gromacs couldn't find my force field in
the directory. Here is my forcefield.
ffnonbonded
[ atomtypes ]
; name mass chargeptype sigma eps
HW 1 1.0
