30 Apr
2010
30 Apr
'10
3:33 a.m.
Yes, you can: phenix.refine model.{pdb,mtz} strategy=individual_sites+rigid_body refine.sites.rigid_body="resseq 1" refine.sites.individual="not resseq 1" In the above command the residue number 1 will be refined as a rigid body while the coordinates of the rest will be refined individually. Pavel. On 4/29/10 2:17 PM, Ralf W. Grosse-Kunstleve wrote:
Is it possible to specify individual residues of a chain to undergo rigid refinement while the rest of the chain does regular refinement?
No, sorry. Ralf _______________________________________________ phenixbb mailing list [email protected] http://phenix-online.org/mailman/listinfo/phenixbb