[gmx-users] how to edit pdb file

Justin A. Lemkul jalemkul at vt.edu
Wed May 21 16:50:25 CEST 2008


Quoting "Wei, Xiupeng" <xiupeng-wei at uiowa.edu>:

> Dear GMX users,
>          I have a basic question. I want to put two same box in x direction.
> So I need increase the number of atoms and change their x coordinates,then
> combine it with the original one. But the file created by Excel can't be
> recoganized by gromacs. Is there any method in Gromacs to handle that? I also
> used Matlab, but it can't read pdb file correctly. Thanks.

genconf -nbox 2 1 1

>
> Best regards,
> xiupeng
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========================================

Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul at vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin/

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