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Hi Again-- > > > Is there a way to incorporate phosphoserine (and others) into a > > structure? Thanks in advance! > > It certainly has been many times- you may wish to contact a group which > has published XPLOR work which includes phosphoserine. I noticed that > parameters can be generated from this site: > http://xray.bmc.uu.se/hicup/SEP/ > It turns out that Marius is just now working on a system with phosphoserine and phosphocysteine. No phosphotyrosine yet. Input files for topology and parameters can be found at http://nmr.cit.nih.gov/xplor-nih/updates/2.10/ We'll probably modify these slightly, but it's a start. regards-- Charles - -- Charles Schwieters email: [email protected] www: http://schwieters.org/cds phone: (301) 402-4914 PGP key: http://schwieters.org/cds/pgp.txt -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.2.1 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.8 <http://mailcrypt.sourceforge.net/> iD8DBQFCg1s6PK2zrJwS/lYRAgodAJ4p+QZbZSZnH1/I6R3HGMgQczbQoQCfbh+K veVYI98OS6Jj2KkC3jWC4o8= =5c6g -----END PGP SIGNATURE-----
