| Objective-Reinforced Generative Adversarial Networks (ORGAN) for Sequence Generation Models GL Guimaraes, B Sanchez-Lengeling, C Outeiral, PLC Farias, ... arXiv preprint arXiv:1705.10843, 2017 | 616 | 2017 |
| Optimizing distributions over molecular space. An Objective-Reinforced Generative Adversarial Network for Inverse-design Chemistry (ORGANIC) B Sanchez-Lengeling, C Outeiral, GL Guimaraes, A Aspuru-Guzik | 333 | 2017 |
| The prospects of quantum computing in computational molecular biology C Outeiral, M Strahm, J Shi, GM Morris, SC Benjamin, CM Deane Wiley Interdisciplinary Reviews: Computational Molecular Science 11 (1), e1481, 2021 | 193 | 2021 |
| Revitalizing the concept of bond order through delocalization measures in real space C Outeiral, MA Vincent, ÁM Pendás, PLA Popelier Chemical science 9 (25), 5517-5529, 2018 | 130 | 2018 |
| Current structure predictors are not learning the physics of protein folding C Outeiral, DA Nissley, CM Deane Bioinformatics 38 (7), 1881-1887, 2022 | 51 | 2022 |
| Membranome 3.0: Database of single‐pass membrane proteins with AlphaFold models AL Lomize, KA Schnitzer, SC Todd, S Cherepanov, C Outeiral, CM Deane, ... Protein Science 31 (5), e4318, 2022 | 23 | 2022 |
| Investigating the potential for a limited quantum speedup on protein lattice problems C Outeiral, GM Morris, J Shi, M Strahm, SC Benjamin, CM Deane New Journal of Physics 23 (10), 103030, 2021 | 15 | 2021 |
| Codon language embeddings provide strong signals for use in protein engineering C Outeiral, CM Deane Nature Machine Intelligence 6 (2), 170-179, 2024 | 9 | 2024 |
| Deconvolution of conformational exchange from Raman spectra of aqueous RNA nucleosides AL Wilson, C Outeiral, SE Dowd, AJ Doig, PLA Popelier, JP Waltho, ... Communications Chemistry 3 (1), 56, 2020 | 8 | 2020 |
| Discovery and pharmacophoric characterization of chemokine network inhibitors using phage-display, saturation mutagenesis and computational modelling S Vales, J Kryukova, S Chandra, G Smagurauskaite, M Payne, CJ Clark, ... Nature Communications 14 (1), 5763, 2023 | 3 | 2023 |
| Generative artificial intelligence for de novo protein design A Winnifrith, C Outeiral, BL Hie Current Opinion in Structural Biology 86, 102794, 2024 | 2 | 2024 |
| Perfecting antibodies with language models C Outeiral, CM Deane Nature Biotechnology 42 (2), 185-186, 2024 | 1 | 2024 |
| Coupling generative models to virtual screening: Application to organic redox flow batteries D Tabor, C Outeiral, B Sanchez-Lengeling, A Aspuru-Guzik ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 255, 2018 | | 2018 |
Charlotte DeaneProfessor of Structural Bioinformatics, Oxford UniversityVerified email at stats.ox.ac.uk
