| The Cambridge structural database CR Groom, IJ Bruno, MP Lightfoot, SC Ward Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2016 | 8294 | 2016 |
| The druggable genome AL Hopkins, CR Groom Nature reviews Drug discovery 1 (9), 727-730, 2002 | 3994 | 2002 |
| Ligand efficiency: a useful metric for lead selection AL Hopkins, CR Groom, A Alex Drug discovery today 9 (10), 430-431, 2004 | 1996 | 2004 |
| The Cambridge Structural Database in retrospect and prospect CR Groom, FH Allen Angewandte Chemie International Edition 53 (3), 662-671, 2014 | 1125 | 2014 |
| Report on the sixth blind test of organic crystal structure prediction methods AM Reilly, RI Cooper, CS Adjiman, S Bhattacharya, AD Boese, ... Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2016 | 550 | 2016 |
| A review of methods for the calculation of solution free energies and the modelling of systems in solution RE Skyner, JL McDonagh, CR Groom, T van Mourik, JBO Mitchell Physical Chemistry Chemical Physics 17 (9), 6174-6191, 2015 | 487 | 2015 |
| Three-dimensional structure of diferric bovine lactoferrin at 2.8 Å resolution SA Moore, BF Anderson, CR Groom, M Haridas, EN Baker Journal of molecular biology 274 (2), 222-236, 1997 | 476 | 1997 |
| Pheromone binding to two rodent urinary proteins revealed by X-ray crystallography Z Böcskei, CR Groom, DR Flower, CE Wright, SEV Phillips, A Cavaggioni, ... Nature 360 (6400), 186-188, 1992 | 451 | 1992 |
| Heteroaromatic rings of the future WR Pitt, DM Parry, BG Perry, CR Groom Journal of medicinal chemistry 52 (9), 2952-2963, 2009 | 331 | 2009 |
| Atomic interactions and profile of small molecules disrupting protein–protein interfaces: the TIMBAL database AP Higueruelo, A Schreyer, GRJ Bickerton, WR Pitt, CR Groom, ... Chemical biology & drug design 74 (5), 457-467, 2009 | 190 | 2009 |
| Experimental and computational mapping of the binding surface of a crystalline protein AC English, CR Groom, RE Hubbard Protein engineering 14 (1), 47-59, 2001 | 152 | 2001 |
| Locating interaction sites on proteins: the crystal structure of thermolysin soaked in 2% to 100% isopropanol AC English, SH Done, LSD Caves, CR Groom, RE Hubbard Proteins: Structure, Function, and Bioinformatics 37 (4), 628-640, 1999 | 148 | 1999 |
| Knowledge-based approaches to co-crystal design PA Wood, N Feeder, M Furlow, PTA Galek, CR Groom, E Pidcock CrystEngComm 16 (26), 5839-5848, 2014 | 142 | 2014 |
| 1.8 Å crystal structure of the C-terminal domain of rabbit serum haemopexin HR Faber, CR Groom, HM Baker, WT Morgan, A Smith, EN Baker Structure 3 (6), 551-559, 1995 | 138 | 1995 |
| Evaluation of molecular crystal structures using Full Interaction Maps PA Wood, TSG Olsson, JC Cole, SJ Cottrell, N Feeder, PTA Galek, ... CrystEngComm 15 (1), 65-72, 2013 | 116 | 2013 |
| The good, the bad and the twisted: a survey of ligand geometry in protein crystal structures J Liebeschuetz, J Hennemann, T Olsson, CR Groom Journal of computer-aided molecular design 26, 169-183, 2012 | 105 | 2012 |
| Identifying interactions that determine fragment binding at protein hotspots CJ Radoux, TSG Olsson, WR Pitt, CR Groom, TL Blundell Journal of medicinal chemistry 59 (9), 4314-4325, 2016 | 95 | 2016 |
| IRAK-4 inhibitors. Part II: a structure-based assessment of imidazo [1, 2-a] pyridine binding GM Buckley, TA Ceska, JL Fraser, L Gowers, CR Groom, AP Higueruelo, ... Bioorganic & medicinal chemistry letters 18 (11), 3291-3295, 2008 | 87 | 2008 |
| The Hydrogen Bond Environments of 1H-Tetrazole and Tetrazolate Rings: The Structural Basis for Tetrazole–Carboxylic Acid Bioisosterism FH Allen, CR Groom, JW Liebeschuetz, DA Bardwell, TSG Olsson, ... Journal of chemical information and modeling 52 (3), 857-866, 2012 | 77 | 2012 |
| Target analysis: a priori assessment of druggability AL Hopkins, CR Groom Small Molecule—Protein Interactions, 11-17, 2003 | 77 | 2003 |
Ian BrunoCCDCVerified email at ccdc.cam.ac.uk
