Tell Tuttle, PhD

Affiliations: 
2007- Pure & Applied Chemistry University of Strathclyde, Glasgow, Scotland, United Kingdom 
Area:
Computational Chemistry; Materials Chemistry; Physical Organic Chemistry
Website:
http://tuttlelab.com
Google:
"https://scholar.google.co.uk/citations?user=-aH3Gs4AAAAJ&hl=en"
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Publications

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van Teijlingen A, Smith MC, Tuttle T. (2023) Short Peptide Self-Assembly in the Martini Coarse-Grain Force Field Family. Accounts of Chemical Research. 56: 644-654
Ramakrishnan M, van Teijlingen A, Tuttle T, et al. (2023) Integrating Computation, Experiment, and Machine Learning in the Design of Peptide-Based Supramolecular Materials and Systems. Angewandte Chemie (International Ed. in English)
Banerjee S, Macdonald PA, Orr SA, et al. (2022) Hydrocarbon Soluble Alkali-Metal-Aluminium Hydride Surrog[ATES]. Chemistry (Weinheim An Der Bergstrasse, Germany)
van Teijlingen A, Swanson HWA, Lau KHA, et al. (2022) Constant pH Coarse-Grained Molecular Dynamics with Stochastic Charge Neutralization. The Journal of Physical Chemistry Letters. 13: 4046-4051
Kerr WJ, Knox GJ, Reid M, et al. (2021) Catalyst design in C-H activation: a case study in the use of binding free energies to rationalise intramolecular directing group selectivity in iridium catalysis. Chemical Science. 12: 6747-6755
van Teijlingen A, Tuttle T. (2021) Beyond Tripeptides Two-Step Active Machine Learning for Very Large Data sets. Journal of Chemical Theory and Computation
Kerr WJ, Knox GJ, Reid M, et al. (2020) Computationally-Guided Development of a Chelated NHC-P Iridium(I) Complex for the Directed Hydrogen Isotope Exchange of Aryl Sulfones. Acs Catalysis. 10: 11120-11126
van Teijlingen A, Tuttle T, Bouchachia H, et al. (2020) Artificial Intelligence and Health in Nepal. Nepal Journal of Epidemiology. 10: 915-918
Cochrane AR, Kennedy AR, Kerr WJ, et al. (2020) The Natural Product Lepidiline A as an N-Heterocyclic Carbene Ligand Precursor in Complexes of the Type [Ir(cod)(NHC)PPh3)]X: Synthesis, Characterisation, and Application in Hydrogen Isotope Exchange Catalysis Catalysts. 10: 161
Mulvey RE, Pollard V, Young A, et al. (2019) Lithium-Aluminate-Catalyzed Hydrophosphination Applications. Angewandte Chemie (International Ed. in English)
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