[gmx-users] g_select problem

Albert mailmd2011 at gmail.com
Wed Aug 21 17:02:34 CEST 2013


but actually the water name in my system IS "T3P" and the atom name in 
the water model is "O". I've double checked for this.

thx

Albert

On 08/21/2013 04:59 PM, Teemu Murtola wrote:
> If that is really your selection, you are trying to select atoms that have
> both name T3P and O, which is clearly impossible, so nothing gets selected.
>
> Best regards,
> Teemu




More information about the gromacs.org_gmx-users mailing list