On Tue, Mar 13, 2012 at 1:28 PM, Jean-Marc Nuzillard <[email protected]> wrote: > The origin of my previous question to the cdk-list is that > I made a confusion between MDLWriter (does not write molecule properties) > and SDFWriter (really does write molecule properties).
The link are the ioformats... each format has an associated reader and writer. It is best to start from there. > As a matter of fact, it is no fully intuitive to read a multiple molecule > SD file with an IteratingMDLReader and to write it with an SDFWriter. This is already fixed in master: https://github.com/cdk/cdk/tree/master/src/main/org/openscience/cdk/io/iterator but since CDK 1.4 is supposed to be API stable, it is not applied to that branch. Egon -- Dr E.L. Willighagen Postdoctoral Researcher Department of Bioinformatics - BiGCaT Maastricht University (http://www.bigcat.unimaas.nl/) 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 ------------------------------------------------------------------------------ Keep Your Developer Skills Current with LearnDevNow! The most comprehensive online learning library for Microsoft developers is just $99.99! Visual Studio, SharePoint, SQL - plus HTML5, CSS3, MVC3, Metro Style Apps, more. Free future releases when you subscribe now! http://p.sf.net/sfu/learndevnow-d2d _______________________________________________ Cdk-user mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/cdk-user
