[phenixbb] automr : ensemble on command line

Bryan Lepore bryanlepore at gmail.com
Thu Nov 11 16:41:30 PST 2010


On Thu, Nov 11, 2010 at 7:26 PM, Nathaniel Echols <nechols at lbl.gov> wrote:
> try this
> first:
>
> coords="MR_probe_5.pdb" coords="MR_probe_9.pdb" etc.

ok, that seems to be working so far, but FYI the webpage says this :

If you have an ensemble of search models to search for, then specify it as

coords='model_1.pdb model_2.pdb model_3.pdb'

> If that doesn't work, you need to run it from a parameter file
> instead.

same thing as before. anyways, i'll do the other thing.

> Alternately, use phenix.ensembler to generate a single
> multi-model PDB file.

wow, i'll check this out

-bryan



More information about the phenixbb mailing list