you should probably try it and if you run into a specific problem let us
know.
it might be difficult to keep molecules "fixed", I haven't tested that
combination with targeted md restraints. give it a try.
On Tue, Jan 27, 2009 at 8:57 AM, balaji nagarajan
<balaji_sethu.hotmail.com>wrote:
>
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> Dear Carlos !
>
>
>
>
> I would like to keep some molecules
> fixed
>
> and for the rest i would like to do
> Targeted molecular dynamics
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> in this case i have a two types of
> crystal structures of the same DNA sequence
>
> and i would like to go to one from the
> other in either the way
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> is it reasonable to do thisbalajiUOM
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Received on Fri Jan 30 2009 - 01:28:41 PST