Hello to everybody, first i want to say hello. My first post in this mailinglist.
I have a question. I have downloaded the full pubchem compound database and convert all the sdf files to fs Files. Now i have 2138 fs-Files and i have a query.mol and i want to search the top 5 similarity molecules in all fs-Files. My usage: sh: babel Compound_000025001_000050000.fs results2.sdf -query.mol Now i want to put in all fs-Files in this command. How does it work? I found solutions for that problem in java but i need to do this over the commandline. So i hope you could help me. With best, Jochen Schreiber ------------------------------------------------------------------------------ All the data continuously generated in your IT infrastructure contains a definitive record of customers, application performance, security threats, fraudulent activity, and more. Splunk takes this data and makes sense of it. IT sense. And common sense. http://p.sf.net/sfu/splunk-novd2d _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
