mauro.truglio at gmail.com
Tue Apr 27 07:05:35 PDT 2010
I got to understand the syntax to edit and even create "new" chemical groups
for chimera to select (I successfully edited the file __init__.py in
ChemGroups). Now I'm facing this problem with aromatic amines: when
selecting, for example, primary aromatic amine, *I'd like to include also
che C atom in the selection* - not only N,H,H.
With other chemical groups this was easy, thanks to the [1,1,1,0,1]-like
notation. But these aromatic amines are described in a different way,
through the function findAroAmines in miscFind.py, and I'm finding it
difficult to edit it.
Can you help me?
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