Re: [COOT] coot read-only switch

2014-11-07 Thread Debreczeni, Judit
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Re: [COOT] Add other solvent molecules setting

2013-02-14 Thread Debreczeni, Judit
Yes, it can be added to the .coot file like this: (append! *solvent-ligand-list* (list TRS)) or like this for multiple molecules: (append! *solvent-ligand-list* (list TRS XXX YYY)) -- AstraZeneca UK Limited is a

Re: [COOT] refine/improve Rama

2011-09-19 Thread Debreczeni, Judit
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Re: [COOT] python commands for showing / hiding a molecule

2011-06-17 Thread Debreczeni, Judit
http://biop.ox.ac.uk/coot/doc/coot.html#set_002dmol_002ddisplayed Pythonic: set_mol_displayed(imol, state) state is 1 for display and 0 for hide. set_mol_active(imol, state) might also be useful in the same context.

Re: [COOT] change names of maps?

2010-10-26 Thread Debreczeni, Judit
http://www.biop.ox.ac.uk/coot/doc/coot.html#set_002dmolecule_002dname Works for maps too. JED. -- AstraZeneca UK Limited is a company incorporated in England and Wales with registered number: 03674842 and a registered

Re: [COOT] Coot, delete a chain

2010-02-01 Thread Debreczeni, Judit
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

Re: [COOT] Stepped version of sphere refine?

2009-01-26 Thread Debreczeni, Judit
Recently, someone (I'm sorry, I can't recall who, and I couldn't find the post in question) posted a extremely useful scheme script to refine residues in a sphere centered around the active residue. That was Paul. (Who else? ;-) ) I was wondering if anyone knows of a way to alter the

Re: [COOT] Dropping Gtk1 version [was Re: overlapping buttons in molprobity check script]

2009-01-09 Thread Debreczeni, Judit
Is there any particular reason to hang onto the gtk1 port? Seems like all it does is generate bug reports. Indeed. Is there anyone who needs the GTK1 version? (And if so, why?) Thanks, AFAIR Redhat 8 (which is without gtk2) is still used in a number of labs

[COOT] get-monomer crash

2009-01-09 Thread Debreczeni, Judit
A bit related to the thread about dropping gtk1 versions: has anyone experienced this and perhaps could provide a fix/explanation? Symptoms: (get-monomer three-letter-code) makes gtk2 (!) centos-4 coot crash on RHEL4, e.g. with GOL: --- (monomer-molecule-from-3-let-code GOL ) throw from within

Re: [COOT] problem in loading icons

2008-11-17 Thread Debreczeni, Judit
I was wondering if anybody observed this before. When I start coot I get this messages (a long list of errors for the whole content of the folder /sw/share/coot/pixmaps/): Error loading icon: Couldn't recognize the image file format for file

Re: [COOT] Coot 0.5 and colours

2008-09-25 Thread Debreczeni, Judit
To answer your question then, there is no way in 0.5 to turn back to the old behaviour. It might be possible in new versions to enable this, but currently I am against the idea. Running the file through pdbset solves the missing element identifier problem -- not elegant, but quick