Figure 9.

Reaction enumeration (Scenario 5) loading a generic reaction from a MDL RXNfile and two reactant lists from MDL SDfiles. The products from the enumeration are stored as MDL Molfiles. Besides these files a PDF document showing the 2D structure of the products is created. At the end Bioclipse will start up to allow visualization and analysis of the results [39].

Kuhn et al. BMC Bioinformatics 2010 11:159   doi:10.1186/1471-2105-11-159
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