Developing computational algorithms and software to gain theoretical and empirical insights in the use of chemical diversity for determining quantitative structure-activity relationships (QSARs).
This work was funded by the National Institutes of Health through the NIH Roadmap for Medical Research, Grant 1 P20 HG003900-01. Information on the Molecular Libraries Roadmap Initiative can be obtained from http://nihroadmap.nih.gov/molecularlibraries/