2016-01-22 13:40 GMT-07:00 Chang Woon Jang <[email protected]>: > Dear Votca Users, > > I have a question about do_potential option. > > I have 4 bead types. A B C and D. > > If I want A type to be updated first, B type to be updated second, C type to > be updated third, and D type to be updated forth iteration, am I right to > setting do_potential option as follow? > > for A > <do_potential>1 0 0 0</do_potential> > > for B > <do_potential>0 1 0 0</do_potential> > > for C > <do_potential>0 0 1 0</do_potential> > > for D > <do_potential>0 0 0 1</do_potential>
Yes, that looks correct to me! Christoph > > Thank you very much. > > > Best regards, > Changwoon Jang, > > -- > 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 https://groups.google.com/group/votca. > For more options, visit https://groups.google.com/d/optout. -- Christoph Junghans Web: http://www.compphys.de -- 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 https://groups.google.com/group/votca. For more options, visit https://groups.google.com/d/optout.
