Roadrunner is a chemical database application developed and supported by the Informatics Core of the New Mexico Molecular Libraries Screening Center at the University of New Mexico Health Sciences Center. The Roadrunner Project home page is here.

This site is maintained for testing and demonstration purposes. Please feel free to create and account, have a look around and please provide feedback as we continue to develop and add new functionality.

The Roadrunner Demo database contains 230988 substances representing approximately 223166 unique compounds. This represents the NIH Molecular Libraries Small Molecule Repository (MLSMR) DPI as downloaded from PubChem in January 2008. These are the compounds being screened as part of NIH's Molecular Libraries Roadmap. The database also houses all PubChem BioAssay Descriptions and Data associated with the MLSMR substances (also as of January 2008).

A prototype system for automated post-HTS analysis has been implemented. Try it out and please provide feedback!

Substructure searching with SMARTS

Please Login to begin using the Roadrunner application.