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Hello Jeff-- > > What is required to make protocol.loadPDB recognize CYSP residues (CYS with > MTSL attached)? First, in this case it's easier to use initStruct followed by initCoords. To get loadPDB to work here requires modification of psfGen.residueTypes['prot'] and adding the CYSP residue type to protein.top and its parameters to protein.par. It's my intention to streamline the procedure in the near future. best regards-- Charles -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.9 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.8+ <http://mailcrypt.sourceforge.net/> iD8DBQFI25IRPK2zrJwS/lYRAp1rAJ9cXtCQ+Fk/DS5rogcBhEYmMJUWzwCdGTJs Q8N/F/X4zoU6bvsbugHatQM= =lH+i -----END PGP SIGNATURE-----
