Re: [gmx-users] gro to itp

2011-01-27 Thread Justin A. Lemkul
trevor brown wrote: Dear all, I obtained a gro file with g_x2top for a CNT. I deleted [commands] in t and saved it as XXX.itp What is [commands]? Is it true? If no, how can I convert it into .itp? A .gro file contains coordinates, while an .itp file is a topology. They're not intercon

[gmx-users] gro to itp

2011-01-27 Thread trevor brown
Dear all, I obtained a gro file with g_x2top for a CNT. I deleted [commands] in t and saved it as XXX.itp Is it true? If no, how can I convert it into .itp? best, trevor -- gmx-users mailing listgmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archiv