From: Egon W. <eg...@us...> - 2005-03-31 19:01:30
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Update of /cvsroot/cdk/cdk-taverna In directory sc8-pr-cvs1.sourceforge.net:/tmp/cvs-serv9420 Modified Files: README Log Message: Added docs on how to get Taverna CDK aware Index: README =================================================================== RCS file: /cvsroot/cdk/cdk-taverna/README,v retrieving revision 1.1.1.1 retrieving revision 1.2 diff -u -r1.1.1.1 -r1.2 --- README 31 Mar 2005 14:28:00 -0000 1.1.1.1 +++ README 31 Mar 2005 19:01:13 -0000 1.2 @@ -1,2 +1,42 @@ This project deals with embedding CDK in Taverna (taverna.sf.net) in order to get a chemoinformatics workbench. + +This is how to get it going: + +1. download Taverna (FIXME: add details) +2. checkout the cdk-taverna module: + + > cvs -d:ext:US...@cv...:/cvsroot/cdk co cdk-taverna + +3. do something like + + > cd taverna1.0-dist/src/org + > ln -s ../../../cdk-taverna/src/org/openscience + +4. compile CDK with 'ant clean dist-large' and copy the cdk-SOMETHING.jar + into taverna1.0-dist/lib/cdk-large.jar + +5. edit taverna1.0-dist/workbenchlibs.text and add cdk-large.jar + +6. edit taverna1.0-dist/src/META-INF/services/org.embl.ebi.escience.scuflworkers.java.LocalWorker + and add the CDK processing units. E.g. the following line: + + org.openscience.cdk.applications.taverna.ParseSmiles = chemoinformatics:Convert Smiles to Connection Tables + + Where chemoinformatics is the new category (FIXME: subcats possible?) + +7. compile taverna with: + + > cd taverna1.0-dist + > ant fetchjars + > ant + +8. run Taverna with: + + > cd taverna1.0-dist/build/taverna-workbench-1.0 + > export JAVA_HOME=/your/favorite + > sh runme.sh + +9. start reading the Taverna tutorial + + |