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George Patargias

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07/26/2010

08:11 PM GROMACS Bug #465: pdb2gmx with DNA
Many thanks for this.
Best wishes
George
(In reply to comment #4)
> Fixed. We have added proper residue termini t...

07/14/2010

09:20 PM GROMACS Bug #465: pdb2gmx with DNA
I am not sure what atoms are missing.
As far as I am concerned, I built all missing atoms (basically h's) with charm...

07/10/2010

01:00 AM GROMACS Bug #465: pdb2gmx with DNA
Created an attachment (id=489)
pdb file of a 16 base pair DNA
12:56 AM GROMACS Bug #465 (Closed): pdb2gmx with DNA
I am trying to generate a topology of a dna strcture using the charmm dna.rtp file
and the Gromacs git version.
Wi...

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