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Rise of the Machines As a crucial discovery tool, computer-aided drug design is deeply ingrained within the pharma industry. Dr Robert Scoffin at Cresset predicts that the next decade will see its increasing adoption for directing and improving molecular discovery, design and optimisation. Dr Robert Scoffin, Cresset (September 2014)
Keywords: Ligand-based virtual screening, Structure-based drug design, Quantum and molecular mechanics, CADD algorithms, Structure-activity relationships, Pharmacophores
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