Tiago successfully defended his Final Doctoral Examination. Congratulations Dr. Domingues!
His presentation was titled “Estimating Position-Dependent Transport Properties Using MD Simulations”. The Research Committee included Profs. Ronald Coifman (Applied Math/Electrical Engineering), Michael Loewenberg, Vladimir Rokhlin (Computer Science/Math) and Amir Haji-Akbari. We wish Tiago the best in his future postdoc career!
Tiago’s Contributions
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37. Estimating Position-Dependent and Anisotropic Diffusivity Tensors from MD Trajectories: Existing Methods and Future Outlook
Domingues T. S., Coifman R., Haji-Akbari, A. J. Chem. Theory Comput. (2024) 20, 11, 4427–4455.
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36. Effect of Pressure on the Conformational Landscape of Human γD-Crystallin
Kacirani A., Uralcan B., Domingues T. D., Haji-Akbari A. J. Phys. Chem. B (2024) 128, 20, 4931–4942.
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34. Divergence among Local Structure, Dynamics, and Nucleation Outcome in Heterogeneous Nucleation of Close-Packed Crystals
Domingues T. S, Hussain S., Haji-Akbari, A. J. Phys. Chem. Lett. (2024) 15, 5, 1279–1287.
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31. Robust Estimation of Position-Dependent Anisotropic Diffusivity Tensors from Molecular Dynamics Trajectories.
Domingues T. S, Coifman R. R., Haji-Akbari A. J. Phys. Chem. B (2023) 127: 8644–8659.
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30. Robust Estimation of Position-Dependent Anisotropic Diffusivity Tensors from Stochastic Trajectories.
Domingues T. S, Coifman R. R., Haji-Akbari A. J. Phys. Chem. B (2023) 127: 5273–5287.
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29. Ideal Conductor Model: An Analytical Finite-Size Correction for Nonequilibrium Molecular Dynamics Simulations of Ion Transport through Nanoporous Membranes.
Shoemaker B. A, Domingues T. S, Haji-Akbari A. J. Chem. Theory Comput. (2022) 18: 7142-7154.
