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Hello Tom-- > 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. What error messages are you getting? Are tyou you trying to use more than one psf from the PRODRG2 server? - that probably doesn't work so well. best regards-- Charles -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.6 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.8+ <http://mailcrypt.sourceforge.net/> iD8DBQFGM1EHPK2zrJwS/lYRAoIRAKCI6lir+5NoZihSBfSRzI2iNB6d3ACfQbVD DGXVLPfOOlNJLka9b1/oB9g= =Yy4+ -----END PGP SIGNATURE-----
