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Full rate constant matrix contraction method for obtaining branching ratio of unimolecular decomposition.
J Comput Chem. 2017 Jan 15;38(2):101-109. doi: 10.1002/jcc.24526. Epub 2016 Oct 31.
2
A global reaction route mapping-based kinetic Monte Carlo algorithm.
J Chem Phys. 2016 Jul 14;145(2):024105. doi: 10.1063/1.4954660.
3
Undirected, Homogeneous C-H Bond Functionalization: Challenges and Opportunities.
ACS Cent Sci. 2016 May 25;2(5):281-92. doi: 10.1021/acscentsci.6b00032. Epub 2016 May 2.
4
Artificial Force Induced Reaction (AFIR) Method for Exploring Quantum Chemical Potential Energy Surfaces.
Chem Rec. 2016 Oct;16(5):2232-2248. doi: 10.1002/tcr.201600043. Epub 2016 Jun 3.
5
Computational Catalysis Using the Artificial Force Induced Reaction Method.
Acc Chem Res. 2016 Apr 19;49(4):763-73. doi: 10.1021/acs.accounts.6b00023. Epub 2016 Mar 29.
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Automated Prediction of Catalytic Mechanism and Rate Law Using Graph-Based Reaction Path Sampling.
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7
Combining Quantum Mechanics Methods with Molecular Mechanics Methods in ONIOM.
J Chem Theory Comput. 2006 May;2(3):815-26. doi: 10.1021/ct050289g.
10
An automated transition state search using classical trajectories initialized at multiple minima.
Phys Chem Chem Phys. 2015 Jun 14;17(22):14912-21. doi: 10.1039/c5cp02175h.

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