Hi Jagur,
If you have Gaussian, you can try using MCPB, released as part of AmberTools 1.5 and subsequent versions.
Best,
Ben
On 11/05/2012, at 8:12 AM, Jagur Lambix wrote:
> I am trying to carry out a MD simulation of a protein having a Zinc ion
> with five coordination bonds.
> I would like to ask a question about the parameters for the Zinc.
> Can anyone please let me know, how to prepare the parameters for such type
> of Zinc ion.
> I am using AMBER 11/AmberTools.
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Received on Thu May 10 2012 - 16:00:04 PDT
