Fernanda Duarte
University of Oxford
H-index: 34
Europe-United Kingdom
Top articles of Fernanda Duarte
Title | Journal | Author(s) | Publication Date |
|---|---|---|---|
Studies on the selectivity of the SARS-CoV-2 papain-like protease reveal the importance of the P2′ proline of the viral polyprotein | RSC Chemical Biology | HT Henry Chan Lennart Brewitz Petra Lukacik Claire Strain-Damerell Martin A Walsh | 2024 |
Responsive Anionophores with AND Logic Multi‐stimuli activation | Angewandte Chemie | Manzoor Ahmad Toby G Johnson Martin Flerin Fernanda Duarte Matthew J Langton | 2024/3/22 |
CageCavityCalc (C3): A computational tool for calculating and visualizing cavities in Molecular Cages | Vicente Martí-Centelles Tomasz Krzysztof Piskorz Fernanda Duarte | 2024/2/13 | |
Template‐Directed Synthesis of Strained meso‐meso‐Linked Porphyrin Nanorings | Angewandte Chemie International Edition | Jeff M Van Raden Jie‐Ren Deng Henrik Gotfredsen Janko Hergenhahn Michael Clarke | 2024/1/17 |
PythiaCHEM: a user-friendly machine learning toolkit for chemistry | Stamatia Zavitsanou Zonghua Bo Emanuele Casali Matthew Langton Fernanda Duarte | 2024/1/12 | |
Taming nonclassical carbocations to control small ring reactivity | Science Advances | Ryan E McNamee Nils Frank Kirsten E Christensen Fernanda Duarte Edward A Anderson | 2024/1/12 |
Visible Light Photoredox-Catalyzed Decarboxylative Alkylation of 3-Aryl-Oxetanes and Azetidines via Benzylic Tertiary Radicals and Implications of Benzylic Radical Stability | J. Org. Chem. | Maryne A. J. Dubois Juan J. Rojas Alistair J. Sterling Hannah C. Broderick Milo A. Smith | 2023 |
Dynamical nonequilibrium molecular dynamics simulations identify allosteric sites and positions associated with drug resistance in the SARS-CoV-2 main protease | JACS Au | HT Henry Chan A Sofia F Oliveira Christopher J Schofield Adrian J Mulholland Fernanda Duarte | 2023/6/7 |
Mass spectrometric assays monitoring the deubiquitinase activity of the SARS-CoV-2 papain-like protease inform on the basis of substrate selectivity and have utility for … | Bioorganic & Medicinal Chemistry | Lennart Brewitz HT Henry Chan Petra Lukacik Claire Strain-Damerell Martin A Walsh | 2023/11/15 |
Mobile Molecules: Reactivity Profiling Guides Faster Movement on a Cysteine Track | Angewandte Chemie International Edition | Zonghua Bo Zhong Hui Lim Fernanda Duarte Hagan Bayley Yujia Qing | 2023/5/15 |
Mutate and Conjugate: A Method to Enable Rapid In-Cell Target Validation | ACS Chemical Biology | Adam M Thomas Marta Serafini Emma K Grant Edward AJ Coombs Joseph P Bluck | 2023/10/24 |
Catalytic enantioselective nucleophilic desymmetrization of phosphonate esters | Nature Chemistry | Michele Formica Tatiana Rogova Heyao Shi Naoto Sahara Branislav Ferko | 2023/5 |
Substrate recognition and selectivity in SARS-CoV-2 main protease: Unveiling the role of subsite interactions through dynamical nonequilibrium molecular dynamics simulations | bioRxiv | HT Henry Chan A Sofia F Oliveira Adrian J Mulholland Christopher J Schofield Fernanda Duarte | 2023 |
Beyond strain release: Delocalization-enabled organic reactivity | Alistair Sterling Russell Smith Edward Anderson Fernanda Duarte | 2023/10/13 | |
Picking the Lock of Coordination Cage Catalysis | Tomasz Piskorz Vicente Martí Centelles Rebecca Spicer Fernanda Duarte Paul Lusby | 2023 | |
Redox Reorganization: Aluminium Promoted 1, 5‐Hydride Shifts Allow the Controlled Synthesis of Multisubstituted Cyclohexenes | Angewandte Chemie | Lewis B Smith Roly J Armstrong Jingyan Hou Edward Smith Ming Sze | 2023/9/4 |
Amino-oxetanes as amide isosteres by an alternative defluorosulfonylative coupling of sulfonyl fluorides | Nature Chemistry | Juan J Rojas Rosemary A Croft Alistair J Sterling Edward L Briggs Daniele Antermite | 2022/2 |
Bending a photonic wire into a ring | Nature Chemistry | Henrik Gotfredsen Jie-Ren Deng Jeff M Van Raden Marcello Righetto Janko Hergenhahn | 2022/12 |
Reaction dynamics of Diels–Alder reactions from machine learned potentials | Physical Chemistry Chemical Physics | Tom A Young Tristan Johnston-Wood Hanwen Zhang Fernanda Duarte | 2022 |
Synthesis of meta-substituted arene bioisosteres from [3.1.1]propellane | Nature | Nils Frank Jeremy Nugent Bethany R Shire Helena D Pickford Patrick Rabe | 2022/11/24 |
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