Hello, everyone! I'm trying to start using VOTCA a polymer simulated in my group. First, I've installed it and it seems to work. Then, I've created a mapping file and ready to start with VOTCA itself.
I tried to run csg_map for my simple system with a command taken from the VOTCA manual: csg_map.exe --top topol.tpr --trj traj.xtc --cg O-BAPB_8.xml --out csg_out.gro The output of this command is the following Reading file topol.tpr, VERSION 4.6.3 (single precision) I have 570 beads in 1 molecules I have 88 beads in 1 molecules for the coarsegraining Reading frame 0 time 0.000 writing coarse-grained trajectory to csg_out.gro an error occurred: output format not supported: csg_out.gro It seems that the topology was correctly translated. But what's wrong with output format? What should I do additionaly to translate atomistic trajectory into the coarsegrained one? Thanks for the help in advance. Sincerely, Sergey -- 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. For more options, visit https://groups.google.com/groups/opt_out.
