Greetings, Has anyone successfully generated small molecule structures with XPLOR-NIH? I have topology and parameter files obtained from the Dundee PRODRG2 site ( http://davapc1.bioch.dundee.ac.uk/programs/prodrg/), and I have a *.psf but it seems there is some error that prevents me from visualizing or doing minimizations. Any suggestions are welcome.
Thanks, Tom Anderson
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