(Very) Recent AI advances for Chemical Engineering research and education Incorporation of Linear Scaling Relations into Automatic Mechanism Generation for Heterogeneous Catalysis Automated transition state theory calculations of abstraction reactions by hydroperoxyl, compared to literature model values 2015 US Combustion Meeting - West - Identification, Correction, and Comparison
of Detailed Kinetic Models RMG at the Flame Chemistry Workshop 2014 Profiling and optimizing RAM and CPU use in RMG-Py Finding Transition States Algorithmically for Automatic Reaction Mechanism Generation 2011 US Combustion Meeting - Kinetic Modeling of Methyl Formate Oxidation AIChE 2011 - Multiphysics Model of Diesel Injector Deposit Formation AIChE 2011 - Automatic Reaction Mechanism Generation with Group Additive Kinetics Reaction Mechanism Generator: Cheminformatics for Kinetic Modeling Northeastern University
Boston, MA United States
Assistant Professor