Marino, E., LaCour, R.A., Moore, T. C., van Dongen, S., Keller, A.W., An, D., Yang, S., Rosen, D.J., Gouget, G., Tsai, E. H. R., Kagan, C. R., Kodger, T. E., Glotzer, S. C., and Murray, C. B. Crystallization of binary nanocrystal superlattices revealed by in situ x-ray scattering and the relevance of short-ranged attraction. Nature Synthesis, accepted
Dwyer, T., Moore, T. C., Anderson, J. A., and Glotzer, S. C. Tunable assembly of host–guest colloidal crystals. Soft Matter (2023)
Moore, T. C., Rivera-Rivera, L. Y., and Glotzer, S. C. Inverse design of triblock janus spheres for self-assembly of complex structures in the crystallization slot via digital alchemy. Soft Matter 19 (2023), pp. 2726–2736
Shamaprasad, P., Frame, C. O., Moore, T. C., Yang, A., Iacovella, C. R., Bouwstra, J. A., Bunge, A. L., and McCabe, C. Using molecular simulation to understand the skin barrier. Progress in Lipid Research (2022), p. 101184
LaCour, R. A., Moore, T. C., and Glotzer, S. C. Tuning stoichiometry to promote formation of binary colloidal superlattices. Physical Review Letters 128 (2022)
Shamaprasad, P., Moore, T. C., Xia, D., Iacovella, C.R., Bunge, A.L., and McCabe, C. Multiscale simulation of ternary stratum corneum lipid mixtures: Effects of cholesterol composition. Langmuir 38 (2022), pp. 7496–7511
Moore, T. C., Anderson, J. A., and Glotzer, S. C. Shape-driven entropic self-assembly of an open, reconfigurable, binary host–guest colloidal crystal. Soft Matter 17 (2021), pp. 2840–2848
Yang, A., Moore, T. C., Iacovella, C. R., Thompson, M., Moore, D. J., and McCabe, C. Examining tail and headgroup effects on binary and ternary gel-phase lipid bilayer structure. The Journal of Physical Chemistry B 124 (2020), pp. 3043–3053
Adorf, C. S., Moore, T.C., Melle, Y., and Glotzer, S. C. Analysis of self-assembly pathways with unsupervised machine learning algorithms. The Journal of Physical Chemistry B 124 (2020), pp. 69–78
Moore, T. C., Yang, A. H., Ogungbesan, O., Hartkamp, R., Iacovella, C. R., Zhang, Q., and McCabe, C. Influence of single-stranded DNA coatings on the interaction between graphene nanoflakes and lipid bilayers. The Journal of Physical Chemistry B 123 (2019), pp. 7711–7721
Moore, T. C., Hartkamp, R., Iacovella, C. R., Bunge, A. L., and McCabe, C. Effect of ceramide tail length on the structure of model stratum corneum lipid bilayers. Biophysical Journal 114 (2018), pp. 3113–3123
Hartkamp, R., Moore, T. C., Iacovella, C. R., Thompson, M. A., Bulsara, P. A., Moore, D. J., and McCabe, C. Composition dependence of water permeation across multicomponent gel-phase bilayers. The Journal of Physical Chemistry B 122 (2018), pp. 3113–3123
Moore, T. C., Iacovella, C. R., Leonhard, A. C., Bunge, A. L., and McCabe, C. Molecular dynamics simulations of stratum corneum lipid mixtures: a multiscale perspective. Biochemical and Biophysical Research Communications 498 (2017), pp. 313–318
Hartkamp, R., Moore, T. C., Iacovella, C. R., Thompson, M. A., Bulsara, P. A., Moore, D. J., and McCabe, C. Investigating the structure of multicomponent gel-phase lipid bilayers. Biophysical Journal 111 (2016), pp. 813–823
Hartkamp, R., Moore, T. C., Iacovella, C. R., Thompson, M. A., Bulsara, P. A., Moore, D. J., and McCabe, C. Structural properties of phospholipid-based bilayers with long-chain alcohol molecules in the gel phase. The Journal of Physical Chemistry B 120 (2016), pp. 12863–12871
Moore, T. C., Iacovella, C. R., Hartkamp, R., Bunge, A. L., and McCabe, C. A coarse-grained model of stratum corneum lipids: free fatty acids and ceramide NS. The Journal of Physical Chemistry B 120 (2016), pp. 9944–9958
Moore, T. C., Iacovella, C. R., and McCabe, C. Development of a coarse-grained water forcefield via multistate iterative Boltzmann inversion. In Foundations of Molecular Modeling and Simulation. Springer (2016), pp. 37–52
Moore, T. C., Iacovella, C. R., and McCabe, C. Derivation of coarse-grained potentials via multistate iterative Boltzmann inversion. The Journal of Chemical Physics 140 (2014), p. 224104
Guo, S., Moore, T. C., Iacovella, C. R., Strickland, L. A., and McCabe, C. Simulation study of the structure and phase behavior of ceramide bilayers and the role of lipid headgroup chemistry. Journal of Chemical Theory and Computation 9 (2013), pp. 5116–5126
