Export .pml
script to visualize restraints in pymol
#47
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This PR adds an optional argument
--pml <output_f>
to thetbl
,ti
,unambig-ti
andrestraint
subcommands.When this optinal argument is defined the restraints will also be outputted as a PyMOL script file (
.pml
) which can then be loaded together with the input for a convenient visualization of the restraints:example:
or the true-interface with the
ti
subcommand:Imporant to note is that this will only take
CA
as anchor atoms - i'll work on a better logic in a different PR - but this one should work for protein-related things