[gmx-users] recovering topology

Mark Abraham Mark.Abraham at anu.edu.au
Wed May 18 08:45:42 CEST 2011


On 18/05/2011 4:34 PM, Ramachandran G wrote:
> Hi gmx-users:
>      Is it possible to recover the topology from cpt file, it is so.. 
> how and what command i need to use?

No, it is not stored there. It can be found only in .itp/.top/.tpr 
files, in various forms.

Mark



More information about the gromacs.org_gmx-users mailing list