Use CloneData instead of SetData.
On 17 September 2012 15:16, Jon Fuller <jonathan.ful...@gmail.com> wrote:
> Dear All,
>
> I had a question about the use of OBMol.SetData() through the Java
> bindings. I would expect to be able to do something like this:
>
> OBCommentData comment = new OBCommentData()
> comment.SetData("This is a comment");
> comment.SetAttribute("cmt");
> mol.SetData(comment);
>
> Then to read back something like this:
> OBCommentData commentBack = (OBCommentData) mol.GetData("cmt");
>
>
> However the SetData method does not exist in the OBMol class. As I
> understand this differs to the C++ classes:
> e.g. http://openbabel.org/dev-api/classOpenBabel_1_1OBGenericData.shtml
> where I could use (here for the OBAtom):
> atom.SetData(label);
>
> Could anyone provide a suggestion as to how I should approach this problem?
>
> I am using the OpenBabel 2.3.1 jar file (and related install).
>
> Many thanks in advance,
>
> Jon Fuller
>
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Live Security Virtual Conference
Exclusive live event will cover all the ways today's security and
threat landscape has changed and how IT managers can respond. Discussions
will include endpoint security, mobile security and the latest in malware
threats. http://www.accelacomm.com/jaw/sfrnl04242012/114/50122263/
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