Pavel Don't worry about this error as I reprocessed the data and started the refinement over and it doesn't seem to be causing an error when doing twin refinement with water picking. I imagine it has something to do with using a def file from a previous phenix version. FR On Mar 25, 2009, at 3:04 PM, Pavel Afonine wrote:
Thanks for the files, I will have a look. Pavel.
On 3/25/09 2:01 PM, Francis E Reyes wrote:
Command: phenix.refine *004.def --overwrite --unused_ok refinement.input.xray_data.r_free_flags.generate=True
and the def file is enclosed.
I turned off ordered_solvent and it seems to be working OK with the twin refinement (I can actually make it into simulated annealing).
On Mar 25, 2009, at 3:00 PM, Pavel Afonine wrote:
--------------------------------------------- Francis Reyes M.Sc. 215 UCB University of Colorado at Boulder
gpg --keyserver pgp.mit.edu --recv-keys 67BA8D5D
8AE2 F2F4 90F7 9640 28BC 686F 78FD 6669 67BA 8D5D
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--------------------------------------------- Francis Reyes M.Sc. 215 UCB University of Colorado at Boulder gpg --keyserver pgp.mit.edu --recv-keys 67BA8D5D 8AE2 F2F4 90F7 9640 28BC 686F 78FD 6669 67BA 8D5D