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2020 – today
- 2020
[j8]A. Patrícia Bento
, Anne Hersey, Eloy Felix, Gregory A. Landrum, Anna Gaulton, Francis Atkinson, Louisa J. Bellis, Marleen De Veij, Andrew R. Leach:
An open source chemical structure curation pipeline using RDKit. J. Cheminformatics 12(1): 51 (2020)
2010 – 2019
- 2019
- [j7]Nicolas Bosc, Francis Atkinson, Eloy Felix, Anna Gaulton, Anne Hersey, Andrew R. Leach:
Large scale comparison of QSAR and conformal prediction methods and their applications in drug discovery. J. Cheminformatics 11(1): 4:1-4:16 (2019) - [j6]Nicolas Bosc, Francis Atkinson, Eloy Felix, Anna Gaulton, Anne Hersey, Andrew R. Leach:
Reply to "Missed opportunities in large scale comparison of QSAR and conformal prediction methods and their applications in drug discovery". J. Cheminformatics 11(1): 64:1-64:3 (2019) - [j5]David Mendez, Anna Gaulton, A. Patrícia Bento, Jon Chambers, Marleen De Veij, Eloy Felix, María P. Magariños, Juan F. Mosquera, Prudence Mutowo-Meullenet, Michal Nowotka, María Gordillo-Marañón, Fiona M. I. Hunter, Laura Junco, Grace Mugumbate, Milagros Rodríguez-López, Francis Atkinson, Nicolas Bosc, Chris J. Radoux, Aldo Segura-Cabrera, Anne Hersey, Andrew R. Leach:
ChEMBL: towards direct deposition of bioassay data. Nucleic Acids Res. 47(Database-Issue): D930-D940 (2019) - 2017
- [j4]Anna Gaulton, Anne Hersey, Michal Nowotka, A. Patrícia Bento, Jon Chambers, David Mendez, Prudence Mutowo-Meullenet, Francis Atkinson, Louisa J. Bellis, Elena Cibrián-Uhalte, Mark Davies, Nathan Dedman, Anneli Karlsson, María P. Magariños, John P. Overington, George Papadatos, Ines Smit, Andrew R. Leach:
The ChEMBL database in 2017. Nucleic Acids Res. 45(Database-Issue): D945-D954 (2017) - [j3]Christoph Thiel, Henrik Cordes, Lorenzo Fabbri, Hélène Eloise Aschmann, Vanessa Baier, Ines Smit, Francis Atkinson, Lars Mathias Blank, Lars Kuepfer:
A Comparative Analysis of Drug-Induced Hepatotoxicity in Clinically Relevant Situations. PLoS Comput. Biol. 13(2) (2017) - 2015
- [j2]Mark Davies, Michal Nowotka, George Papadatos, Nathan Dedman, Anna Gaulton, Francis Atkinson, Louisa J. Bellis, John P. Overington:
ChEMBL web services: streamlining access to drug discovery data and utilities. Nucleic Acids Res. 43(Webserver-Issue): W612-W620 (2015) - 2014
- [j1]Rodrigo Ochoa, Mark Davies, George Papadatos, Francis Atkinson, John P. Overington:
myChEMBL: a virtual machine implementation of open data and cheminformatics tools. Bioinform. 30(2): 298-300 (2014)
Coauthor Index
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