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The New Mexico Molecular Libraries Screening Center Chemical Database Application |
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Welcome to Roadrunner @ NMMLSCThis Application is for the use of New Mexico Molecular Libraries Screening Center members only. A public Roadrunner demo is available here. 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. The Roadrunner NMMLSC database currently 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. The screening sets currently (and previously) being screened by the NMMLSC are represented by the various DPI libraries in the following table:
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.
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