Extract molecule scaffolds¶
A program that removes all atoms that are not ring atoms nor atoms in
linkers between rings. By default double bonded atoms exo to a ring
are included as ring atoms. This can be changed by using the flag
-exo.
Example¶
prompt> ExtractScaffold dbase.oeb.gz
prompt> ExtractScaffold -exo false -i dbase.oeb.gz -o output.oeb.gz