An introduction to the computer science and chemistry of chemical information systems
Copyright © 2009 by Craig A. James, eMolecules, Inc.
The original version of this introduction to cheminformatics can be found on the eMolecules website. It is included here with the permission of the author.
- Cheminformatics Basics
- Representing Molecules
- Substructure Searching with Indexes
- Molecular Similarity
- Chemical Registration Systems