Hey, onle one mapping per molecule type is enough, so it's ok. You can always check mapping with csg_map.
Cheers, Victo 2010/9/21 Sikandar Mashayak <[email protected]>: > Hi > > I am looking into tutorial files for force-matching. In case of propane , > reference system contains just one molecule and three CG beads have been > defined in map file. > Suppose reference system contains many molecules of same type, (e.g. bulk > water with 216 molecules), do we have to specify CG bead for each 216 > molecules . That is do we need to define 216 CG beads using residue > id,name,atom from reference .gro file? Or just one definition like following > is enough > > <cg_bead> > <name>CG</name> > <type>CG</type> > <mapping>A</mapping> > <beads> > 1:SOL:OW 1:SOL:HW1 1:SOL:HW2 > </beads> > </cg_bead> > thanks > sikandar > > -- > You received this message because you are subscribed to the Google Groups > "votca" group. > To post to this group, send email to [email protected]. > To unsubscribe from this group, send email to > [email protected]. > For more options, visit this group at > http://groups.google.com/group/votca?hl=en. > -- You received this message because you are subscribed to the Google Groups "votca" group. To post to this group, send email to [email protected]. To unsubscribe from this group, send email to [email protected]. For more options, visit this group at http://groups.google.com/group/votca?hl=en.
