11 Dec
2009
11 Dec
'09
10:05 p.m.
For example: phenix.refine model.pdb data.mtz strategy=individual_sites main.bulk_solvent_and_scale=false refine.sites.individual="chain A and backbone" main.number_of_macro_cycles=10 where you can use a fake mtz file (using pbbtools). Or: phenix.pdbtools model.pdb --geometry-regularization but I forgot if it takes the atom selection - you can quickly try it out. Pavel. On 12/11/09 1:57 PM, Raja Dey wrote:
Hi, Does PHENIX has the option to simply minimize the energy of a homolgy model with C-alpha atoms or backbone fixed (in absence of x-ray data)? Thanks... Raja
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