[gmx-users] Residue modifications
Anu Tervo
ajtervo at csc.fi
Tue Jun 24 18:33:00 CEST 2003
Hi all,
I'd like to get some advice for my task in hand. I need to remove HG atom
from one Ser residue in my protein to get a free OG atom. What would be
the best way to do this: just delete the corresponding atom from .top and
manually edit atom numbers to match again, create an .rtp file for Ser
- HG residue, or define HG as a dummy atom (in this case, what dummy would
be the best for this usage)?
Ciao,
-Anu
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