[phenixbb] phenix.refine read .geo file
osobolev at lbl.gov
Thu Oct 8 12:15:07 PDT 2020
The .geo file outputted by Phenix cannot be read back in. To manually set
or edit some restraints, please refer to the docs here:
If the restraint is already present, please use "action = change" instead
Please let us know if you have any questions.
On Wed, Oct 7, 2020 at 7:41 PM Sheila Boreiko <sheila_boreiko at hotmail.com>
> Dear all,
> For the sake of some experiment, I would like to manually edit some
> restraints of a geometry restraint file (normally named .geo) and ask for
> phenix.refine to read this edited file rather than producing a new one, is
> this possible? What should be the command line to read this geometry
> restraint file be?
> Thank you,
> phenixbb mailing list
> phenixbb at phenix-online.org
> Unsubscribe: phenixbb-leave at phenix-online.org
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