Chemical component files
"Steve Darnell" <[email protected]>
| Newsgroups | gmane.comp.java.bio.general |
|---|---|
| Message-ID | <[email protected]> |
Greetings, I would like to install a local instance of the Chemical Component Dictionary (CCD) for use with BioJava's chemical component functionality. The wwPDB distributes the CCD as a single file; however, ChemCompGroupFactory.java and related classes expect individual cif.gz files. The individual cif.gz files are downloaded on-the-fly from http://www.rcsb.org/pdb/files/ligand/, but they are not discoverable from a web browser. Where can I find the individual files that form the CCD? Am I overlooking a utility to use the single file version? Best regards, Steve _______________________________________________ Biojava-l mailing list - [email protected] http://lists.open-bio.org/mailman/listinfo/biojava-l