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Drug design/discovery computational systems

Drug discovery scientists have already adopted tools such as combinatorial chemistry synthesizers robotic systems for HTS and software packages for computational chemistry, molecular modeling, and design of experiments to identify lead compounds ( hits ). As the number of hits grows, there is a potential for process R D to become the bottleneck. The number... [Pg.3005]

Profile This privately held company was founded in 1993 to integrate advanced technologies in structure-based design, combinatorial chemistry, and chemi-informatics for the cost-effective discovery of orally active pharmaceuticals. The company has developed a system capable of generating new drugs through computer-controlled robotic synthesis and analysis of chemical libraries. Current drug discovery efforts are focused on cardiovascular disease and cancer. [Pg.287]


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