Modellers
I would like to make a DOPE profile for a modeled protein containing a chemically modified side chain. I used the script suggested in the Advanced Tutorial with the following lines to read the library files containing information about the modified residue.
env = environ(restyp_lib_file='${LIB}/restyp_tom.lib') env.libs.topology.read(file='$(LIB)/top_heav_tom.lib') # read topology env.libs.parameters.read(file='$(LIB)/par_tom.lib') # read parameters
The DOPE profile is created by the script but the modified residue is left out of the profile.
Any suggestions would be appreciated.
Tom