editconf periodic box center issue
This bug must be well known; however, I could not find it on the bugzilla search page.
The editconf program still fails to place the solute in the center of the solvent box in gromacs version 4.0.3. The editconf program in version 3.1.2 works perfectly fine and I've been using this version of editconf for now. For example, the following command works fine (i.e. automatically centers) in version 3.1.2, but fails to center in version 4.0.3
editconf -f conf.gro -bt octahedron -d 1.0 -o box.gro
Setting the center manually with -center works fine in version 4.0.3. It would be nice to have autocenter back (pretty please!). Thanks,