8th International Conference on Chemical Kinetics presentation on Finding Transition States Automatically

At the 8th International Conference on Chemical Kinetics, Dr. West presented the group’s work on Finding Transition States Algorithmically for Automatic Reaction Mechanism Generation. (Presentation date: July 12, 2013.)

We presented an automatic procedure to generate the transition state geometries that are required for automatic calculations of reaction rates via TST, in the context of automatic kinetic model building software.


Read Extended Abstract
View on SlideShare.net.

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