On 08/21/2013 05:06 PM, Justin Lemkul wrote:
Your selection, as Teemu says, is calling for *atoms* named T3P that
are also *atoms* named O, which is clearly impossible. The *residue*
name is T3P.
-Justin
I see. thanks a lot for clearly pointing out. I changed it into
resname T3P
and it works very well now.
thanks all you guys.
best
Albert
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