[gmx-users] Space between the columns in the topology file of Gromacs

Mark Abraham mark.j.abraham at gmail.com
Fri Jun 16 00:02:42 CEST 2017


Hi,

Those are simply fields separated by whitespace. Columns not relevant.

Mark

On Thu, 15 Jun 2017 22:10 lan hoa Trinh <trinhlanhoa at gmail.com> wrote:

> Dear Gromacs society,
> I wonder if there is the default for the space between the columns in the
> topology file, for example:
> [ bonds ]
> ;ai     aj      func    r0(nm)  Kb
>         1        2     1 3.805916447e-01 2.000000000e+04
>         2        3     1 3.788218579e-01 2.000000000e+04
>         3        4     1 3.790369375e-01 2.000000000e+04
>
> Should it be fixed that ai, aj  at the fix positions, i.e. 8 spaces of tab
> size for example?
> I am looking forward to hearing from you.
> Best regards,
> *Lan Hoa*
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