Markush Darc expresses the genericity which is present
in patent chemical structures by the use of generic
groups as well as infinite and closed set superatoms. New tools
are offered to the user for performing more
efficient searches: superatom translation attributes and variable
positions of attachment may now be input
in the structure query. Operation of these new functionalities is
described within screen searchBit Screen
and FRELs screenand the exact atom-by-atom match. The
contribution of superatoms to the Bit Screen
content, the reduction of FRELs subgraph, and the effects of superatom
translation on the backtracking
mechanism of atom-by-atom search are discussed. Associated
optimizations of the whole system were
necessary to earn maximal efficiency from these strategic changes in
the software.
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