Green Research Group
Fundamental and Applied Chemical Kinetics
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Biblio Author:
William H. Green
2021
Matthew S. Johnson
Mark R. Nimlos
Erik Ninneman
Andrew Laich
Gina M. Fioroni
Dongil Kang
Lintao Bu
Duminda Ranasinghe
Sarah Khanniche
S. Scott Goldsborough
Subith S. Vasu
William H. Green
2021
Oxidation and pyrolysis of methyl propyl ether
International Journal of Chemical Kinetics
53
915-938
2021
Alon Grinberg Dana
Haoyang Wu
Duminda Ranasinghe
Frank C. Pickard IV
Geoffrey P. F. Wood
Todd Zelesky
Gregory W. Sluggett
Jason Mustakis
William H. Green
2021
Kinetic Modeling of API Oxidation: 1. The AIBN/H2O/CH3OH Radical “Soup”
Molecular Pharmaceutics
18
3037–3049
2021
Kabir Ahuja
William H. Green
Yi-Pei Li
2021
Learning to Optimize Molecular Geometries Using Reinforcement Learning
Journal of Chemical Theory and Computation
17
818-825
2021
Mengjie Liu
Alon Grinberg Dana
Matthew S. Johnson
Mark J. Goldman
Agnes Jocher
A. Mark Payne
Colin A. Grambow
Kehang Han
Nathan W. Yee
Emily J. Mazeau
Katrin Blondal
Richard H. West
C. Franklin Goldsmith
William H. Green
2021
Reaction Mechanism Generator v3.0: Advances in Automatic Mechanism Generation
Journal of Chemical Information and Modeling
61
2686–2696
2021
Florence H. Vermeire
William H. Green
2021
Transfer learning for solvation free energies: From quantum chemistry to experiments
Chemical Engineering Journal
418
129307
2020
Lagnajit Pattanaik
Octavian-Eugen Ganea
Ian Coley
Klavs F. Jensen
William H. Green
Connor W. Coley
2020
Message Passing Networks for Molecules with Tetrahedral Chirality
2021
Mengjie Liu
Te‐Chun Chu
Agnes Jocher
Mica C. Smith
Istvan Lengyel
William H. Green
2021
Predicting polycyclic aromatic hydrocarbon formation with an automatically generated mechanism for acetylene pyrolysis
International Journal of Chemical Kinetics
53
27-42
2021
Yanfei Guan
Connor W. Coley
Haoyang Wu
Duminda Ranasinghe
Esther Heid
Thomas J. Struble
Lagnajit Pattanaik
William H. Green
Klavs F. Jensen
2021
Regio-selectivity prediction with a machine-learned reaction representation and on-the-fly quantum mechanical descriptors
Chemical Science
12
2198-2208
2020
Pieter P. Plehiers
Connor W. Coley
Hanyu Gao
Florence H. Vermeire
Maarten R. Dobbelaere
Christian V. Stevens
Kevin M. Van Germ
William H. Green
2020
Artificial Intelligence for Computer-Aided Synthesis In Flow: Analysis and Selection of Reaction Conditions
Frontiers in Chemical Engineering
2
5
2020
I-Yun Lisa Hsieh
William H. Green
2020
Transition to Electric Vehicles in China: Implications for Total Cost of Ownership and Cost to Society
SAE International Journal of Sustainable Transportation, Energy, Environment, & Policy
1
2
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