[phenixbb] ready set and H/D addition on waters

Maxime Cuypers maximecuypers at gmail.com
Sat Nov 22 12:30:32 PST 2014


after not using phenix for a while, i just realised the new versions do not
include the option in ready_set gui to add H or D atoms to waters in the
pdb models (and only to the waters without altering the rest of the model
would be nice). of course it can be done on the command line but why has it
been removed? it is a very neutron crystallographer friendly option don t
you think?

Dr. Maxime Cuypers
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