Thanks, Judit.
It worked for everything, the whole chain, a part of a chain and for all
waters.
Debreczeni, Judit wrote:
How about this:
1. click on the bin in the toolbar and select "Delete zone"
2. go to the first residue in the chain (in the Go to atom window or
with ^g), click on the residue
3. similarly, go to the last one and click that
-> Coot should delete the chain (it will take a while...)
It that seems a little fiddly, try this:
---
(define (delete-chain imol chain-id)
(if (and (string? chain-id) and (number? imol))
(let* ((n-res (chain-n-residues chain-id imol))
(start (seqnum-from-serial-number imol chain-id 0))
(end (seqnum-from-serial-number imol chain-id (- n-res
1))))
(delete-residue-range imol chain-id start end))))
---
where imol is the molecule number and chain-id is the chain you want to
delete.
using it like e.g.: (delete-chain 0 "A")
JED.
How nice would it be to be able to delete chains/residues in the go to
atom window... or renumber residues and change chain IDs and copy
fragments by simple drag-and-drop... sigh.
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-----Original Message-----
From: Mailing list for users of COOT Crystallographic Software
[mailto:c...@jiscmail.ac.uk] On Behalf Of Maia Cherney
Sent: 31 January 2010 20:07
To: COOT@JISCMAIL.AC.UK
Subject: Re: [COOT] Coot, delete a chain
Hi all,
Is there a way to delete the whole chain of a complex?
Or all solvent atoms at once?
Maia
