[phenixbb] phenix.ligandfit, specifiy already generated cif file
guenter.fritz.phenix.ccp4 at gmail.com
Fri Jan 22 01:59:22 PST 2021
I would like to run phenix.ligandfit with a cif file I have already
generated with acedrg or grade.
This is not really required, just for comparison reasons. Would be nice.
There is the parameter
cif_already_generated= False / True
But how do I define the cif file?
Many thanks and best regards!
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the phenixbb