On Thu, 19 Feb 2004, E.L. Willighagen wrote:
> Could you try this:
>
> - --- src/org/openscience/jmol/app/JmolEditBus.java 17 Feb 2004 15:36:02
> +++ src/org/openscience/jmol/app/JmolEditBus.java 19 Feb 2004 11:03:48
> @@ -102,6 +102,6 @@ public class JmolEditBus implements CDKE
> }
>
> public ChemFile getChemFile() {
> - - throw new NoSuchMethodError();
> + return (ChemFile)viewer.getClientFile();
> }
> }
Thanks, I'll try it later in the evening.
Perhaps I could describe my plugin plan a bit. The plugin would make some
comp.chem. methods available into Jmol. It would read the current
atoms/bonds from Jmol, send them to a remote server (using a socket
perhaps?) along with other instructions (calculate energy, optimize
structure perhaps), and wait for a reply. Then it would display the
calculated energy and pass the optimized structure back to Jmol. I have
planned to use "ghemical" as the remote server (please see
http://bioinformatics.org/ghemical/).
So I think this could bring more functionality into Jmol and offer an
alternative user interface to ghemical (eventually once finished).
Tommi
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