The weights are normalized when doing the mapping, so it doesn't matter. Victor
2013/6/5 <[email protected]> > > > On Wednesday, June 5, 2013 8:53:26 AM UTC+1, Emiliano Brini wrote: >> >> Hi, >> >> you can simply set the weight of the alpha carbon to 1 and all the other >> atoms of the beads to 0 . >> >> Bye >> Emiliano >> > > Thank you! > Do you mean 1 or 12? It will not change anything I guess... > > >> >> On Jun 5, 2013, at 9:10 AM, [email protected] wrote: >> >> Dear Votca Users, >> >> Would you please advise me how to adjust weights in the xml file in order >> to obtain beads at the centre of mass on Calpa - central carbon atoms? I >> know that for the centre of geometry all weight will be equal but I wish to >> have my beads where Calpha atoms are. >> >> Thank you in advance, >> >> Steven >> >> -- >> You received this message because you are subscribed to the Google Groups >> "votca" group. >> To unsubscribe from this group and stop receiving emails from it, send an >> email to votca+un...@**googlegroups.com. >> To post to this group, send email to [email protected]. >> >> Visit this group at >> http://groups.google.com/**group/votca?hl=en<http://groups.google.com/group/votca?hl=en> >> . >> For more options, visit >> https://groups.google.com/**groups/opt_out<https://groups.google.com/groups/opt_out> >> . >> >> >> >> >> -- > You received this message because you are subscribed to the Google Groups > "votca" group. > To unsubscribe from this group and stop receiving emails from it, send an > email to [email protected]. > To post to this group, send email to [email protected]. > Visit this group at http://groups.google.com/group/votca?hl=en. > For more options, visit https://groups.google.com/groups/opt_out. > > > -- You received this message because you are subscribed to the Google Groups "votca" group. To unsubscribe from this group and stop receiving emails from it, send an email to [email protected]. To post to this group, send email to [email protected]. Visit this group at http://groups.google.com/group/votca?hl=en. For more options, visit https://groups.google.com/groups/opt_out.
