| Quantitative structure–property relationship modeling of diverse materials properties T Le, VC Epa, FR Burden, DA Winkler Chemical reviews 112 (5), 2889-2919, 2012 | 581 | 2012 |
| Lyotropic liquid crystal engineering–ordered nanostructured small molecule amphiphile self-assembly materials by design C Fong, T Le, CJ Drummond Chemical Society Reviews 41 (3), 1297-1322, 2012 | 353 | 2012 |
| Machine learning for electrocatalyst and photocatalyst design and discovery H Mai, TC Le, D Chen, DA Winkler, RA Caruso Chemical Reviews 122 (16), 13478-13515, 2022 | 257 | 2022 |
| Discovery and optimization of materials using evolutionary approaches TC Le, DA Winkler Chemical reviews 116 (10), 6107-6132, 2016 | 209 | 2016 |
| Systematic comparison of the structural and dynamic properties of commonly used water models for molecular dynamics simulations SP Kadaoluwa Pathirannahalage, N Meftahi, A Elbourne, ACG Weiss, ... Journal of Chemical Information and Modeling 61 (9), 4521-4536, 2021 | 170 | 2021 |
| Performance of deep and shallow neural networks, the universal approximation theorem, activity cliffs, and QSAR DA Winkler, TC Le Molecular informatics 36 (1-2), 1600118, 2017 | 147 | 2017 |
| Capturing the crystal: prediction of enthalpy of sublimation, crystal lattice energy, and melting points of organic compounds M Salahinejad, TC Le, DA Winkler Journal of chemical information and modeling 53 (1), 223-229, 2013 | 83 | 2013 |
| Internet of Things and autonomous control for vertical cultivation walls towards smart food growing: A review MN Halgamuge, A Bojovschi, PMJ Fisher, TC Le, S Adeloju, S Murphy Urban Forestry & Urban Greening 61, 127094, 2021 | 82 | 2021 |
| Aqueous solubility prediction: do crystal lattice interactions help? M Salahinejad, TC Le, DA Winkler Molecular pharmaceutics 10 (7), 2757-2766, 2013 | 81 | 2013 |
| Janus particles: recent advances in the biomedical applications TC Le, J Zhai, WH Chiu, PA Tran, N Tran International journal of nanomedicine, 6749-6777, 2019 | 79 | 2019 |
| An experimental and computational approach to the development of ZnO nanoparticles that are safe by design TC Le, H Yin, R Chen, Y Chen, L Zhao, PS Casey, C Chen, DA Winkler Small 12 (26), 3568-3577, 2016 | 76 | 2016 |
| Manipulating the ordered nanostructure of self-assembled monoolein and phytantriol nanoparticles with unsaturated fatty acids N Tran, X Mulet, AM Hawley, C Fong, J Zhai, TC Le, J Ratcliffe, ... Langmuir 34 (8), 2764-2773, 2018 | 65 | 2018 |
| Quantitative design rules for protein-resistant surface coatings using machine learning TC Le, M Penna, DA Winkler, I Yarovsky Scientific reports 9 (1), 265, 2019 | 59 | 2019 |
| Prediction of O2/N2 Selectivity in Metal–Organic Frameworks via High-Throughput Computational Screening and Machine Learning IB Orhan, H Daglar, S Keskin, TC Le, R Babarao ACS Applied Materials & Interfaces 14 (1), 736-749, 2021 | 46 | 2021 |
| A bright future for evolutionary methods in drug design TC Le, DA Winkler ChemMedChem 10 (8), 1296-1300, 2015 | 36 | 2015 |
| A review on the application of molecular descriptors and machine learning in polymer design Y Zhao, RJ Mulder, S Houshyar, TC Le Polymer Chemistry 14 (29), 3325-3346, 2023 | 35 | 2023 |
| In meso crystallization: compatibility of different lipid bicontinuous cubic mesophases with the cubic crystallization screen in aqueous solution L van’t Hag, C Darmanin, TC Le, S Mudie, CE Conn, CJ Drummond Crystal growth & design 14 (4), 1771-1781, 2014 | 33 | 2014 |
| Review on the use of artificial intelligence to predict fire performance of construction materials and their flame retardancy HT Nguyen, KTQ Nguyen, TC Le, G Zhang molecules 26 (4), 1022, 2021 | 31 | 2021 |
| Machine learning approaches to understand and predict rate constants for organic processes in mixtures containing ionic liquids TL Greaves, KSS McHale, RF Burkart-Radke, JB Harper, TC Le Physical Chemistry Chemical Physics 23 (4), 2742-2752, 2021 | 31 | 2021 |
| Toward cell membrane biomimetic lipidic cubic phases: a high-throughput exploration of lipid compositional space S Sarkar, N Tran, MH Rashid, TC Le, I Yarovsky, CE Conn, CJ Drummond ACS Applied Bio Materials 2 (1), 182-195, 2018 | 31 | 2018 |
Winkler, D*CSIRO or Monash or La Trobe or Defence or Nottingham or PharmacyVerified email at latrobe.edu.au