[gmx-users] How to make a pdb file for methane pair?
xianghong001 at gmail.com
Wed Oct 22 13:30:45 CEST 2008
Thanks, so how to edit a residue name ? I am confused. sorry about such
On Tue, Oct 21, 2008 at 9:01 PM, Mark Abraham <Mark.Abraham at anu.edu.au>wrote:
> xianghong qi wrote:
>> Hello, everyone,
>> I want to create a pdb file for methane pair . I can make methane pair
>> from MOE and then save to pdb file format without any residue name there.
>> The question is that I can't convert pdb file to .gro file from gromacs
>> without residue name. Anyone has any idea about this question. I appreciate
>> your help.
> You don't need a .gro file for itself.. see
> You'll need a residue name to get a topology defined, so edit one in.
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