On 25/01/12 16:46, Kendall Nettles wrote:
I know my message was not very clear. I'm thinking of occasions where the ligands are symmetrical, or we have a mixture of compounds and are not sure which regioisomer to fit. We would load the maps and models of other structures with related compounds to compare the density for the ligand, which I think can help with ligand fitting.
And if you want to see that tool in action come to the Spring BCA meeting. Or CCP4 WG2. Oh.. err.. woops :-/ Paul.
