Re: [phenixbb] Cannot activate NCS in 1.10.1

Hi Eckhard, My guess would be that newer versions fail to find NCS in your structure. There should be some indication of this fact in the log files. I'm happy to check what is going on and introduce any fixes if needed. Can you please send me (off-list) model and data files to reproduce the behavior you described? The files will be kept in confidence. Best regards, Oleg Sobolev. On Mon, Jan 25, 2016 at 3:51 AM, Eckhard Hofmann < [email protected]> wrote:

Hi all, during finalization of a structure I wanted to quickly check the effect of cartesion vs. torsion ncs. Surprisingly changing settings in the GUI did not effect the stats at all (numerically identical runs). I did a quick check with

Release 2155 (1.10.1) Release 1692 (1.9) Release 2294 (dev)

on the commandline with just the pdb and mtz and with and without main.ncs=true (old version) ncs_search.enabled=True (new versions)

Again nothing changed in the stats in the new versions, whereas the old version correctly stated the identified torsion NCS-pairs in the log and gave diverging stats.

Maybe I'am triggering a bug here? I know the ncs code is under reconstruction, but no change (especially in log output) is troublesome.

Cheers, Eckhard

-- Prof. Dr. Eckhard Hofmann Ruhr-Uni Bochum AG Proteinkristallographie, LS Biophysik, ND04/318 44780 Bochum Tel: +49-(0)234/32-24463, Sekr. -24461, FAX: -14762 ORCID: 0000-0003-4874-372X _______________________________________________ phenixbb mailing list [email protected] http://phenix-online.org/mailman/listinfo/phenixbb Unsubscribe: [email protected]