On Fri, Jun 01, 2012, Benjamin Haley wrote:
>
> I want to create polymer chains and pack them into a volume,
> adjusting torsion angles to minimize interactions with other chains
> (and self-interaction within a chain). One method for doing this is
> the configurational bias Monte Carlo sampling. Can this (or
> something similar) be done in AMBER?
No. We basically have no Monte Carlo capabilities along the lines you are
talking about.
....dac
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Received on Fri Jun 01 2012 - 10:00:04 PDT
