Grambow CA, Jamal A, Li Y-P, Green WH, Zador J, Suleimanov YV.  2018.  Unexpected Unimolecular Reaction Pathways of a ?-Ketohydroperoxide from Combined Application of Automated Reaction Discovery Methods Journal of the American Chemical Society. 140:1035-1048.

Suleimanov YV, Green WH.  2015.  Automated Discovery of Elementary Chemical Reaction Steps Using Freezing String and Berny Optimization Methods�. Journal of Chemical Theory & Computation. 11:4248.

Li Y, Suleimanov YV, Green WH, Guo H.  2014.  Quantum Rate Coefficients and Kinetic Isotope Effect for the Reaction Cl + CH4 –> HCl + CH3 from Ring Polymer Molecular Dynamics. Journal of Physical Chemistry A. 118:1989-1996.

Suleimanov YV, Kong WJ, Guo H, Green WH.  2014.  Ring Polymer Molecular Dynamics: Rate Coefficient Calculations for Energetically Symmetric (Near Thermoneutral) Insertion Reactions X+ H2 = XH + H (X=C(1D),S(1D)). Journal of Chemical Physics. 141:3.

Prozument K, Suleimanov YV, Buesser B, Oldham JM, Green WH, Suits AG, Field RW.  2014.  Signature of Roaming Dynamics in the Thermal Decomposition of Ethyl Nitrite: Chirped Pulse Rotational Spectroscopy and Kinetic Modeling. Journal of Physical Chemistry Letters. 5:3641-3648.

de Tudela RPe?rez, Suleimanov YV, Richardson JO, Ra?banos VSa?ez, Green WH, F. Aoiz J.  2014.  Stress Test for Quantum Dynamics Approximations: Deep Tunnelling in the Muonium Exchange Reaction D+HMu = H + DMu. Journal of Physical Chemistry Letters. 5:4219-4224.

Gonzalez-Lavado E, Corchado JC, Suleimanov YV, Green WH, Espinosa-Garcia J.  2014.  Theoretical Kinetics Study of the O(3P) + CH4/CD4 Hydrogen Abstraction Reaction: The Role of Anharmonicity, Recrossing Effects and Quantum Mechanical Tunneling. Journal of Physical Chemistry A. 118:3243.

Allen JW, Green WH, Li Y, Guo H, Suleimanov YV.  2013.  Full dimensional quantum rate coefficients and kinetic isotope effects from ring polymer molecular dynamics for a seven-atom reaction OH + CH4 CH3 + H2O. J. Chem. Phys.. 138:221103.

Li Y, Suleimanov YV, Li J, Green WH, Guo H.  2013.  Rate coefficients and kinetic isotope effects of the X + CH4 + HX (X = H, D, Mu) reactions from ring polymer molecular dynamics. Journal of Chemical Physics. 138

Li Y, Suleimanov YV, Yang M-H, Green WH, Guo H.  2013.  Ring Polymer Molecular Dynamics Calculations of Thermal Rate Constants for the O(3P) + CH4 OH + CH3 Reaction: Contributions of Quantum Effects. Journal of Physical Chemistry Letters. 4:48.

Suleimanov YV, Allen JW, Green WH.  2013.  RPMDrate: bimolecular chemical reaction rates from ring polymer molecular dynamics. Computer Physics Communications. 184:833-840.