Re: [AMBER] Setting Atom Types

From: Bill Ross <ross.cgl.ucsf.EDU>
Date: Tue, 25 May 2010 11:29:45 -0700

> > desc x
> UNIT name: ROH
> Head atom: .R<ROH 1>.A<HO1 1>
> Tail atom: .R<0GB 2>.A<C2 19>
> Contents:
> R<ROH 1>
> R<0GB 2>
> > set x head x.2.O2
> The value must be of the type: Atom

How about

set x head x.ROH.2.02 ?

Noting that "UNIT name: ROH" with residues 1 & 2 in it.

Bill

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Received on Tue May 25 2010 - 11:30:08 PDT
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