VMD-L Mailing List
From: John Stone (johns_at_ks.uiuc.edu)
Date: Wed Oct 24 2007 - 17:24:52 CDT
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Hi,
You could presumably write a NAMDBin restart file from VMD, but you'd
probably be just as well served by writing a PDB I'm guessing. Try using
$sel writenamdbin foo.coor
Cheers,
John Stone
johns_at_ks.uiuc.edu
On Wed, Oct 24, 2007 at 11:33:05AM +1000, poker_at_physics.usyd.edu.au wrote:
> Is there a text command available to write a loaded molecule in vmd as a
> .coor file used for NAMD simulations?
>
> I'm planning on using such a command in an automated script to save time
> manually converting pdb files into NAMD binary coordinates.
>
> Thanks,
> Poker.
>
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-- NIH Resource for Macromolecular Modeling and Bioinformatics Beckman Institute for Advanced Science and Technology University of Illinois, 405 N. Mathews Ave, Urbana, IL 61801 Email: johns_at_ks.uiuc.edu Phone: 217-244-3349 WWW: http://www.ks.uiuc.edu/~johns/ Fax: 217-244-6078
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