On Wed, Apr 1, 2020 at 4:19 AM Dongze Wang <[email protected]> wrote: > > Dear all, > > I use csg_stat to provide correct intervals for distribution. My system has 5 > beads ( number 1-5), according to the tutorials I write my setting files for > different interactions but the output seems a little bit weird (see Plot, 2-2 > means the non-bonded interactions between two type 2 bead). Here is the code > for that: > <cg> > <non-bonded> > <name>2-2</name> > <type1>2</type1> > <type2>2</type2> > <min>1</min> > <max>30</max> > <step>0.5</step> > </non-bonded> > > </cg> > > My question is: Is my script correct? And how to analyse this output plot to > determine correct interval for force matching. > Thanks for your help. Looks ok to me! I would say 3.5 to 26 would be a good range, just pick something above 0, so that the force matrix has some entries.
Christoph > > Dongze > > -- > 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 view this discussion on the web visit > https://groups.google.com/d/msgid/votca/d34b1698-648b-445e-b467-9593d75ec0d4%40googlegroups.com. -- 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 view this discussion on the web visit https://groups.google.com/d/msgid/votca/CAHG27e7AgcAOc2-xwnbRR-wWPAM08rwcL1V7LHHuAnPU22rtKw%40mail.gmail.com.
