Subject: docking software for molecule-surface affinity ?

From: M Brunsteiner <m.brunsteiner.-at-.ucl.ac.uk>
Date: Fri, 30 May 2003 09:52:36 +0100

Dear all,

Can anybody point me to a (preferably free are reasonably priced)
software that can do docking between a given surface structure
and a range of organic molecules/polymers ? 

Can any of the programs that are used for bio-receptor/ligand
or protein-protein interactions (such as dock, autodock flexx, etc)
be used for this purpose ?

thanks in advance for any help!
cheers,
Michael

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"Emotions are alien to me.  I'm a scientist."
(Spock, "This Side of Paradise", stardate 3417.3)

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Michael Brunsteiner
Centre for Theoretical and Computational Chemistry
University College London
mailto:m.brunsteiner.-at-.ucl.ac.uk
http://www.ucl.ac.uk/~uccambr/
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