On 04/20/2013 09:03 PM, Ethan A Merritt wrote:
I really disapprove of the idea of writing out ANISOU records to describe TLS refinement. Notwithstanding the fact that the PDB recommends this, I strongly suggest that you tell refmac_not_ to write out ANISOU records. The TLS model is adequately described in the header, the extra ANISOU records are a less good way of describing the same thing.Ethan
I agrees with you. But I am using phenix for the refinement, unfortunately there is no option for it not to write the ANISOU records.
Lithlin
