Hi Nick,

thanks for your report; I'm on it.

Cheers,
Jon

On Fri, 29 Mar 2019 at 12:18, Nicholas Keep <n.k...@mail.cryst.bbk.ac.uk>
wrote:

> I have found a 'feature' in molprobity.  if there are two atoms on top
> of each other (not hard to do by mistake when adding waters in coot),
> then molprobity does not work or at least does not give the outputs
> required to then give the coot molprobity checklist file our of the
> ccp4i2 refmac interface.  A check at some point for this mistake would
> be good to throw out a clear error message.
>
> Best wishes
>
> Nick
>
>
> --
> Prof Nicholas H. Keep
> Executive Dean of School of Science
> Professor of Biomolecular Science
> Crystallography, Institute for Structural and Molecular Biology,
> Department of Biological Sciences
> Birkbeck,  University of London,
> Malet Street,
> Bloomsbury
> LONDON
> WC1E 7HX
>
> email     n.k...@mail.cryst.bbk.ac.uk
> Telephone 020-7631-6852  (Room G54a Office)
>            020-7631-6800  (Department Office)
> Fax       020-7631-6803
> If you want to access me in person you have to come to the crystallography
> entrance
> and ring me or the department office from the internal phone by the door
>
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-- 
Dr Jon Agirre
Royal Society University Research Fellow
York Structural Biology Laboratory / Department of Chemistry
University of York, Heslington, YO10 5DD, York, UK
http://www.york.ac.uk/chemistry/research/ysbl/people/staff/jagirre/
Office: /B/K/065 Phone: +44 (0) 1904 32 8252
Twitter: @alwaysonthejazz

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