Properties

  • 129. Integrating Computation, Experiment, and Machine Learning in the Design of Peptide-Based Supramolecular Materials and Systems

    Angew. Chem. Int. Ed., 2023, 62, e202218067

    Ramakrishnan, M.; van Teijlingen, A.; Tuttle, T.

    Angew. Chem. Int. Ed. 2023 62 e202218067

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  • 128. COGITO: A Coarse-Grained Force Field for the Simulation of Macroscopic Properties of Triacylglycerides

    Acc. Chem. Res. 2023, 19, 4, 1333-1341

    Cordina, R. J.; Smith, B.; Tuttle, T.

    J. Chem. Theory Comput. 2023 19 1333-1341

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  • 125. Hydrocarbon Soluble Alkali-Metal-Aluminium Hydride Surrog[ATES]

    Chem. Eur. J. 2022, e202201085

    Banerjee S.;Macdonald P. A.; Orr S. A.; Kennedy A. R.; van Teijlingen A.; Robertson S. D.; Tuttle T.; Mulvey, R. E.

    Chemistry - A European Journal 2022 e202201085

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  • 123. Constant pH Coarse-Grained Molecular Dynamics with Stochastic Charge Neutralization

    J. Phys. Chem. Lett. 2022, 13, 4046.

    van Teijlingen, A.; Swanson, H. W. A.; Lau, K. H. A.; Tuttle, T.

    J. Phys. Chem. Lett. 2022 13 4046.

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