Re: [votca] error in installing votca with gromacs

2016-10-17 9:07 GMT-06:00 : > Hi all, > > I am trying to get my head around on to run votca with gromacs input files. > > These are the following steps i am following in the installation - > > prefix=/usr/local/votca > sudo mkdir -p ${prefix}/src > cd ${prefix}/src > sudo

[votca] error in installing votca with gromacs

Hi all, I am trying to get my head around on to run votca with gromacs input files. These are the following steps i am following in the installation - prefix=/usr/local/votca sudo mkdir -p ${prefix}/src cd ${prefix}/src sudo curl -O

Re: [votca] Bonded Potential

2016-10-14 14:49 GMT-06:00 John Voorehes : > I have recently completed the tutorial for the bonded interactions for > hexane using csg_boltzmann on single molecule of hexane. So it has for > bonded potential, a A-B bond only. However, for my molecule, the beads are > different