ggasoftware / indigo

Indigo: a cheminformatics toolkit. Bingo: RDBMS data cartridge for Oracle, MS SQL Server, and PostgreSQL
https://lifescience.opensource.epam.com/indigo
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Memory exception while rendering a RXN file as CDXML #9

Open abhimanyusirohi opened 10 years ago

abhimanyusirohi commented 10 years ago

I think the code that renders a reaction file to CDXML is missing from: "indigo/render2d/src/render_cdxml.cpp".

The method RenderParamCdxmlInterface::render is responsible for rendering CDXML format for both molecules and reactions but the code only considers params.mols structure. There is no usage of params.rxns that contains reaction components.

To reproduce: