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Jeroen van

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01/17/2008

02:34 AM GROMACS Bug #185: Wrong NH2-terminus charge groups in G53a6
OK, I found another comment, http://bugzilla.gromacs.org/show_bug.cgi?id=65#c5, and I can confirm that the first part...

01/16/2008

12:12 AM GROMACS Bug #185 (Closed): Wrong NH2-terminus charge groups in G53a6
Created an attachment (id=272)
1AKI.pdb and G53a6 tops
There seems to be some inconsistent behaviour in the assignme...

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