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robert c. glen
robert c. glen
Cambridge University and Imperial College London
Dirección de correo verificada de cam.ac.uk - Página principal
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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
79721997
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
20361995
Molecular similarity: a key technique in molecular informatics
A Bender, RC Glen
Organic & biomolecular chemistry 2 (22), 3204-3218, 2004
7442004
Encyclopedia of computational chemistry
PR Schleyer
(No Title), 1998
5971998
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
5481995
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
5022015
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
4832018
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
4082007
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
4052004
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
3622011
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
3392004
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
3142012
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
2952006
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
2442017
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
2332002
Solubility challenge: can you predict solubilities of 32 molecules using a database of 100 reliable measurements?
A Llinàs, RC Glen, JM Goodman
Journal of chemical information and modeling 48 (7), 1289-1303, 2008
2312008
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
2162011
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
2132005
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
2002022
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
1901995
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Artículos 1–20