Dear Daniel, Did you solve the structure of a small molecule, or do you have a small molecule ligand as part of a protein/ macromolecular complex? In the latter case you don't need checkCIF. Best, Tim
On September 14, 2018 5:43:48 PM GMT+02:00, "Moss, Daniel L" <[email protected]> wrote: >They say for small molecules they want IUCr's CheckCIF validation >report. I think you're on to something and that I may be mistaken. This >is probably not for protein structures and the PDB validation report is >likely enough. I think I will email the journal and confirm. Thanks for >the help! > >Daniel Moss > >-----Original Message----- >From: Paul Emsley <[email protected]> >Sent: Friday, September 14, 2018 10:23 AM >To: Moss, Daniel L <[email protected]>; [email protected] >Subject: Re: [ccp4bb] > >On 14/09/2018 15:50, Moss, Daniel L wrote: >> >> I am trying to generate a checkCIF report for a publication >submission and I am not having any luck. > >That's the wrong sort of cif check :-/ > > > The journal I'm submitting to requires a checkCIF report. > >If so, they are wrong to do so - or you might be trying to submit to >the wrong journal. To be clear, do they need checkCIF or cif >validation? > >Paul. > >######################################################################## > >To unsubscribe from the CCP4BB list, click the following link: >https://www.jiscmail.ac.uk/cgi-bin/webadmin?SUBED1=CCP4BB&A=1 -- Sent from my Android device with K-9 Mail. Please excuse my brevity. ######################################################################## To unsubscribe from the CCP4BB list, click the following link: https://www.jiscmail.ac.uk/cgi-bin/webadmin?SUBED1=CCP4BB&A=1
