| The CCP4 suite: integrative software for macromolecular crystallography J Agirre, M Atanasova, H Bagdonas, CB Ballard, A Baslé, ... Acta Crystallographica Section D: Structural Biology 79 (6), 449-461, 2023 | 133 | 2023 |
| Cryo-EM model validation recommendations based on outcomes of the 2019 EMDataResource challenge CL Lawson, A Kryshtafovych, PD Adams, PV Afonine, ML Baker, ... Nature methods 18 (2), 156-164, 2021 | 80 | 2021 |
| Increase of enzyme activity through specific covalent modification with fragments JF Darby, M Atobe, JD Firth, P Bond, GJ Davies, P O'Brien, RE Hubbard Chemical science 8 (11), 7772-7779, 2017 | 42 | 2017 |
| Design and Synthesis of 56 Shape‐Diverse 3D Fragments TD Downes, SP Jones, HF Klein, MC Wheldon, M Atobe, PS Bond, ... Chemistry (Weinheim an der Bergstrasse, Germany) 26 (41), 8969, 2020 | 41 | 2020 |
| Lead-oriented synthesis: Investigation of organolithium-mediated routes to 3-D scaffolds and 3-D shape analysis of a virtual lead-like library M Luethy, MC Wheldon, C Haji-Cheteh, M Atobe, PS Bond, P O’Brien, ... Bioorganic & Medicinal Chemistry 23 (11), 2680-2694, 2015 | 36 | 2015 |
| Analysis of HypD disulfide redox chemistry via optimization of Fourier transformed ac voltammetric data H Adamson, M Robinson, PS Bond, B Soboh, K Gillow, AN Simonov, ... Analytical chemistry 89 (3), 1565-1573, 2017 | 31 | 2017 |
| Predicting protein model correctness in Coot using machine learning PS Bond, KS Wilson, KD Cowtan Acta Crystallographica Section D: Structural Biology 76 (8), 713-723, 2020 | 19 | 2020 |
| ModelCraft: an advanced automated model-building pipeline using Buccaneer PS Bond, KD Cowtan Acta Crystallographica Section D: Structural Biology 78 (9), 1090-1098, 2022 | 15 | 2022 |
| Comparison of automated crystallographic model-building pipelines E Alharbi, PS Bond, R Calinescu, K Cowtan Acta Crystallographica Section D: Structural Biology 75 (12), 1119-1128, 2019 | 14 | 2019 |
| Shift-field refinement of macromolecular atomic models K Cowtan, S Metcalfe, P Bond Acta Crystallographica Section D: Structural Biology 76 (12), 1192-1200, 2020 | 10 | 2020 |
| Next generation software for placing atoms into electron density maps PS Bond University of York, 2021 | 3 | 2021 |
| Online carbohydrate 3D structure validation with the Privateer web app JS Dialpuri, H Bagdonas, LC Schofield, PT Pham, L Holland, PS Bond, ... Acta Crystallographica Section F: Structural Biology Communications 80 (2), 2024 | 2 | 2024 |
| Predicting the performance of automated crystallographic model-building pipelines E Alharbi, P Bond, R Calinescu, K Cowtan Acta Crystallographica Section D: Structural Biology 77 (12), 1591-1601, 2021 | 2 | 2021 |
| Outcomes of the EMDataResource Cryo-EM Ligand Modeling Challenge C Lawson, A Kryshtafovych, G Pintilie, S Burley, J Cerny, V Chen, ... Research Square, 2024 | | 2024 |
Roderick HubbardUniversity of York and Vernalis (R&D) LtdVerified email at york.ac.uk
