On Sun, Apr 01, 2018, roja rahmani wrote:
>
> I want to simulate ZnS nanotube. But AMBERTOOLS doesn't give me any result.
> I mean does amber have parameters for simulating ZnS?
Amber is primarily a suite of programs for simulating biomolecules. It
does not have any built-in support for ZnS nanontubes.
You could look a MCPB (Metal center parameter builder) or pymsmt for
help with Zn: but these were developed to describe Zn atoms in
metalloenzymes, not in materials science.
....dac
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Received on Mon Apr 02 2018 - 08:00:02 PDT
