Hi there, I had obtained bonded tabulated potentials for our study molecule using csg_boltzmann. Then using the tables of bonded potential, I am working on the non-bonded interaction using csg_inverse. For this, I have edited the settings.xml and grompp.mdp, topol.top of propane tutorial for our system. I compared my files with the propane systems files for ibi run. However, when I ran the csg_inverse --options settings.xml, it terminates (prints"Terminated") without any error message or inverse.log. Could you help me answering what could I have been missing?
-- 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.
