Journal of Cheminformatics

tracked for impact factor

This article is part of the supplement: 5th German Conference on Cheminformatics: 23. CIC-Workshop

Open Access Oral presentation

Representation and searching of biomolecules

Joeseph L Durant*, WL Chen, BD Christie, DL Grier, BA Leland and JG Nourse

  • * Corresponding author: Joeseph L Durant

Author Affiliations

Symyx Technologies, 2440 Camino Ramon, San Ramon, California, USA

For all author emails, please log on.

Journal of Cheminformatics 2010, 2(Suppl 1):O4 doi:10.1186/1758-2946-2-S1-O4

Published: 4 May 2010

First paragraph (this article has no abstract)

Biomolecules present challenges to chemical information systems designed for small molecules. Their sizes, up to tens of thousands of atoms, overwhelm representation/storage/searching solutions built on explicit chemical representation of the structures. But biomolecules are largely made up of many repeats of a limited number of building-block molecules, a fact which has been used to provide a compressed representation for biomolecules using templates for the building blocks.