ACS Medicinal Chemistry Letters – Automated Lead Optimization of MMP-12 Inhibitors Using a Genetic Algorithm
By Stephen D. Pickett, Darren V. S. Green, David L. Hunt, David A. Pardoe, and Ian Hughes. Abstract Traditional lead optimization projects involve long synthesis and testing cycles, favoring extensive structure-activity relationship (SAR) analysis and molecular design steps, in an attempt to limit the number of cycles that a project must run to optimize a [...]


