OLEX2: a complete structure solution, refinement and analysis program OV Dolomanov, LJ Bourhis, RJ Gildea, JAK Howard, H Puschmann Journal of applied crystallography 42 (2), 339-341, 2009 | 28348 | 2009 |
The anatomy of a comprehensive constrained, restrained refinement program for the modern computing environment–Olex2 dissected LJ Bourhis, OV Dolomanov, RJ Gildea, JAK Howard, H Puschmann Acta Crystallographica Section A: Foundations and Advances 71 (1), 59-75, 2015 | 1586 | 2015 |
DIALS: implementation and evaluation of a new integration package G Winter, DG Waterman, JM Parkhurst, AS Brewster, RJ Gildea, M Gerstel, ... Acta Crystallographica Section D: Structural Biology 74 (2), 85-97, 2018 | 951 | 2018 |
Simultaneous femtosecond X-ray spectroscopy and diffraction of photosystem II at room temperature J Kern, R Alonso-Mori, R Tran, J Hattne, RJ Gildea, N Echols, C Glöckner, ... Science 340 (6131), 491-495, 2013 | 472 | 2013 |
Taking snapshots of photosynthetic water oxidation using femtosecond X-ray diffraction and spectroscopy J Kern, R Tran, R Alonso-Mori, S Koroidov, N Echols, J Hattne, M Ibrahim, ... Nature communications 5 (1), 4371, 2014 | 241 | 2014 |
Nanoflow electrospinning serial femtosecond crystallography RG Sierra, H Laksmono, J Kern, R Tran, J Hattne, R Alonso-Mori, ... Acta Crystallographica Section D: Biological Crystallography 68 (11), 1584-1587, 2012 | 217 | 2012 |
Room temperature femtosecond X-ray diffraction of photosystem II microcrystals J Kern, R Alonso-Mori, J Hellmich, R Tran, J Hattne, H Laksmono, ... Proceedings of the National Academy of Sciences 109 (25), 9721-9726, 2012 | 193 | 2012 |
Diffraction-geometry refinement in the DIALS framework DG Waterman, G Winter, RJ Gildea, JM Parkhurst, AS Brewster, ... Acta Crystallographica Section D: Structural Biology 72 (4), 558-575, 2016 | 186 | 2016 |
Accurate macromolecular structures using minimal measurements from X-ray free-electron lasers J Hattne, N Echols, R Tran, J Kern, RJ Gildea, AS Brewster, ... Nature methods 11, 545–548, 2014 | 170 | 2014 |
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 | 167 | 2023 |
Energy-dispersive X-ray emission spectroscopy using an X-ray free-electron laser in a shot-by-shot mode R Alonso-Mori, J Kern, RJ Gildea, D Sokaras, TC Weng, ... Proceedings of the National Academy of Sciences 109 (47), 19103-19107, 2012 | 154 | 2012 |
Scaling diffraction data in the DIALS software package: algorithms and new approaches for multi-crystal scaling J Beilsten-Edmands, G Winter, R Gildea, J Parkhurst, D Waterman, ... Acta Crystallographica Section D: Structural Biology 76 (4), 385-399, 2020 | 117 | 2020 |
Luminescent Iridium (III) Complexes with N∧ C∧ N-Coordinated Terdentate Ligands: Dual Tuning of the Emission Energy and Application to Organic Light-Emitting Devices P Brulatti, RJ Gildea, JAK Howard, V Fattori, M Cocchi, JAG Williams Inorganic Chemistry 51 (6), 3813–3826, 2012 | 113 | 2012 |
New methods for indexing multi-lattice diffraction data RJ Gildea, DG Waterman, JM Parkhurst, D Axford, G Sutton, DI Stuart, ... Acta Crystallographica Section D: Biological Crystallography 70 (10), 2652-2666, 2014 | 76 | 2014 |
Structure of CPV17 polyhedrin determined by the improved analysis of serial femtosecond crystallographic data HM Ginn, M Messerschmidt, X Ji, H Zhang, D Axford, RJ Gildea, G Winter, ... Nature communications 6 (1), 6435, 2015 | 73 | 2015 |
DIALS as a toolkit G Winter, J Beilsten‐Edmands, N Devenish, M Gerstel, RJ Gildea, ... Protein Science 31 (1), 232-250, 2022 | 66 | 2022 |
iotbx.cif: a comprehensive CIF toolbox RJ Gildea, LJ Bourhis, OV Dolomanov, RW Grosse-Kunstleve, ... Journal of Applied Crystallography 44 (6), 1259-1263, 2011 | 64 | 2011 |
Improving signal strength in serial crystallography with DIALS geometry refinement AS Brewster, DG Waterman, JM Parkhurst, RJ Gildea, ID Young, ... Acta Crystallographica Section D: Structural Biology 74 (9), 877-894, 2018 | 61 | 2018 |
Robust background modelling in DIALS JM Parkhurst, G Winter, DG Waterman, L Fuentes-Montero, RJ Gildea, ... Journal of applied crystallography 49 (6), 1912-1921, 2016 | 56 | 2016 |
xia2. multiplex: a multi-crystal data-analysis pipeline RJ Gildea, J Beilsten-Edmands, D Axford, S Horrell, P Aller, J Sandy, ... Acta Crystallographica Section D: Structural Biology 78 (6), 752-769, 2022 | 36 | 2022 |