Difference between revisions of "Template:Format"

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(Additional Comments)
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===Additional Comments===
 
===Additional Comments===
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This format uses molecular fingerprints to prepare and search an index of a multi-molecule datafile. It allows fast substructure and structural similarity searching. The indexing is a slow process (~30 minutes for a 250,000 molecule file). The  subsequent seaching is much faster, a few seconds, and so can be done interactively.

Revision as of 16:45, 26 January 2006

Filename Extensions {{{extensions}}}
Chemical MIME Type {{{mime}}}
Specification URL {{{url}}}
Notes {{{notes}}}

Options

{{{options}}}

Additional Comments

This format uses molecular fingerprints to prepare and search an index of a multi-molecule datafile. It allows fast substructure and structural similarity searching. The indexing is a slow process (~30 minutes for a 250,000 molecule file). The subsequent seaching is much faster, a few seconds, and so can be done interactively.