Re: [ccp4bb] Molprobity "Feature" in ccp4i2 refmac

2019-03-29 Thread Jon Agirre
Hi Nick, thanks for your report; I'm on it. Cheers, Jon On Fri, 29 Mar 2019 at 12:18, Nicholas Keep 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 leas

[ccp4bb] Molprobity "Feature" in ccp4i2 refmac

2019-03-29 Thread Nicholas Keep
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 inte