8 Sep
2009
8 Sep
'09
9:02 p.m.
Does phenix have SA-torsion angle refinement option similar to what is available in CNS?
Yes, with a recent installer (less than a week or two old) you can try it out by adding simulated_annealing_torsion=True in addition to the other settings for turning on simulated annealing. There are some known problems that I didn't have a chance to fix yet, but if it doesn't crash it should be OK. If you get a crash or weird results, let me know. Ralf