| Development and validation of a genetic algorithm for flexible docking G Jones, P Willett, RC Glen, AR Leach, R Taylor Journal of molecular biology 267 (3), 727-748, 1997 | 7898 | 1997 |
| Molecular recognition of receptor sites using a genetic algorithm with a description of desolvation G Jones, P Willett, RC Glen Journal of molecular biology 245 (1), 43-53, 1995 | 2019 | 1995 |
| Molecular similarity: a key technique in molecular informatics A Bender, RC Glen Organic & biomolecular chemistry 2 (22), 3204-3218, 2004 | 731 | 2004 |
| Encyclopedia of computational chemistry PR Schleyer (No Title), 1998 | 596 | 1998 |
| A genetic algorithm for flexible molecular overlay and pharmacophore elucidation G Jones, P Willett, RC Glen Journal of computer-aided molecular design 9, 532-549, 1995 | 542 | 1995 |
| Predicting drug metabolism: experiment and/or computation? J Kirchmair, AH Göller, D Lang, J Kunze, B Testa, ID Wilson, RC Glen, ... Nature reviews Drug discovery 14 (6), 387-404, 2015 | 483 | 2015 |
| Microbiome–host systems interactions: protective effects of propionate upon the blood–brain barrier L Hoyles, T Snelling, UK Umlai, JK Nicholson, SR Carding, RC Glen, ... Microbiome 6, 1-13, 2018 | 463 | 2018 |
| Similarity searching of chemical databases using atom environment descriptors (MOLPRINT 2D): evaluation of performance A Bender, HY Mussa, RC Glen, S Reiling Journal of chemical information and computer sciences 44 (5), 1708-1718, 2004 | 401 | 2004 |
| Random forest models to predict aqueous solubility DS Palmer, NM O'Boyle, RC Glen, JBO Mitchell Journal of chemical information and modeling 47 (1), 150-158, 2007 | 400 | 2007 |
| From in silico target prediction to multi-target drug design: Current databases, methods and applications A Koutsoukas, B Simms, J Kirchmair, PJ Bond, AV Whitmore, S Zimmer, ... Journal of proteomics 74 (12), 2554-2574, 2011 | 357 | 2011 |
| Molecular similarity searching using atom environments, information-based feature selection, and a naive Bayesian classifier A Bender, HY Mussa, RC Glen, S Reiling Journal of chemical information and computer sciences 44 (1), 170-178, 2004 | 337 | 2004 |
| Computational prediction of metabolism: sites, products, SAR, P450 enzyme dynamics, and mechanisms J Kirchmair, MJ Williamson, JD Tyzack, L Tan, PJ Bond, A Bender, ... Journal of chemical information and modeling 52 (3), 617-648, 2012 | 311 | 2012 |
| Circular fingerprints: flexible molecular descriptors with applications from physical chemistry to ADME RC Glen, A Bender, CH Arnby, L Carlsson, S Boyer, J Smith IDrugs 9 (3), 199, 2006 | 288 | 2006 |
| Elabela/toddler is an endogenous agonist of the apelin APJ receptor in the adult cardiovascular system, and exogenous administration of the peptide compensates for the … P Yang, C Read, RE Kuc, G Buonincontri, M Southwood, R Torella, ... Circulation 135 (12), 1160-1173, 2017 | 240 | 2017 |
| Novel Methods for the Prediction of logP, pKa, and logD L Xing, RC Glen Journal of chemical information and computer sciences 42 (4), 796-805, 2002 | 231 | 2002 |
| Solubility challenge: can you predict solubilities of 32 molecules using a database of 100 reliable measurements? A Llinŕs, RC Glen, JM Goodman Journal of chemical information and modeling 48 (7), 1289-1303, 2008 | 227 | 2008 |
| Chemical name to structure: OPSIN, an open source solution DM Lowe, PT Corbett, P Murray-Rust, RC Glen Journal of chemical information and modeling 51 (3), 739-753, 2011 | 211 | 2011 |
| A discussion of measures of enrichment in virtual screening: comparing the information content of descriptors with increasing levels of sophistication A Bender, RC Glen Journal of chemical information and modeling 45 (5), 1369-1375, 2005 | 210 | 2005 |
| SARS-CoV-2 infects the human kidney and drives fibrosis in kidney organoids J Jansen, KC Reimer, JS Nagai, FS Varghese, GJ Overheul, M de Beer, ... Cell stem cell 29 (2), 217-231. e8, 2022 | 190 | 2022 |
| A genetic algorithm for the automated generation of molecules within constraints RC Glen, AWR Payne Journal of Computer-Aided Molecular Design 9, 181-202, 1995 | 189 | 1995 |
