Re: [votca] csg_inverse terminates without inverse.log

2017-02-27 13:35 GMT-07:00 Bijay Shrestha : > 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

[votca] csg_inverse terminates without inverse.log

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