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Chemical network algorithms for the risk assessment and management of chemical threats
Authors:Patrick E Fuller  Chris M Gothard  Nosheen A Gothard  Alex Weckiewicz  Bartosz A Grzybowski
Institution:Department of Chemistry, Northwestern University, 2145 Sheridan Rd., Evanston, IL 60208 (USA) http://dysa.northwestern.edu.
Abstract:A network of chemical threats: Current regulatory protocols are insufficient to monitor and block many short-route syntheses of chemical weapons, including those that start from household products. Network searches combined with game-theory algorithms provide an effective means of identifying and eliminating chemical threats. (Picture: an algorithm-detected pathway that yields sarin (bright red node) in three steps from unregulated substances.).
Keywords:chemical networks  chemical weapons  minimax algorithm  synthetic methods
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