Good to know indeed, thanks :)
2011/7/8 Egon Willighagen <[email protected]>
> On Thu, Jul 7, 2011 at 9:56 PM, Vincent Le Guilloux
> <[email protected]> wrote:
> > Yes indeed; is it that bad ? :)
>
> No, not particularly, but it is good to know there is an option to
> force reading coordinates as 3D :)
>
> MDLV2000Reader reader = new MDLV2000Reader(ins);
> Properties prop = new Properties();
> prop.setProperty("ForceReadAs3DCoordinates","true");
> PropertiesListener listener = new PropertiesListener(prop);
> reader.addChemObjectIOListener(listener);
> reader.customizeJob();
>
> The listener bit is historical... I guess this API will simplify in
> the next series.
>
> Egon
>
>
> --
> Dr E.L. Willighagen
> Postdoctoral Researcher
> Institutet för miljömedicin
> Karolinska Institutet (http://ki.se/imm)
> Homepage: http://egonw.github.com/
> LinkedIn: http://se.linkedin.com/in/egonw
> Blog: http://chem-bla-ics.blogspot.com/
> PubList: http://www.citeulike.org/user/egonw/tag/papers
>
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