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A large-scale crop protection bioassay data set.
Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. Gaulton A, et al. Among authors: van westen gj. Sci Data. 2015 Jul 7;2:150032. doi: 10.1038/sdata.2015.32. eCollection 2015. Sci Data. 2015. PMID: 26175909 Free PMC article.
Large-Scale Modeling of Sparse Protein Kinase Activity Data.
Luukkonen S, Meijer E, Tricarico GA, Hofmans J, Stouten PFW, van Westen GJP, Lenselink EB. Luukkonen S, et al. J Chem Inf Model. 2023 Jun 26;63(12):3688-3696. doi: 10.1021/acs.jcim.3c00132. Epub 2023 Jun 9. J Chem Inf Model. 2023. PMID: 37294674 Free PMC article.
Preclinical evaluation of EpCAM-binding designed ankyrin repeat proteins (DARPins) as targeting moieties for bimodal near-infrared fluorescence and photoacoustic imaging of cancer.
Houvast RD, Badr N, March T, de Muynck LDAN, Sier VQ, Schomann T, Bhairosingh S, Baart VM, Peeters JAHM, van Westen GJP, Plückthun A, Burggraaf J, Kuppen PJK, Vahrmeijer AL, Sier CFM. Houvast RD, et al. Eur J Nucl Med Mol Imaging. 2024 Jul;51(8):2179-2192. doi: 10.1007/s00259-023-06407-w. Epub 2023 Aug 29. Eur J Nucl Med Mol Imaging. 2024. PMID: 37642704 Free PMC article.
Artificial intelligence in multi-objective drug design.
Luukkonen S, van den Maagdenberg HW, Emmerich MTM, van Westen GJP. Luukkonen S, et al. Curr Opin Struct Biol. 2023 Apr;79:102537. doi: 10.1016/j.sbi.2023.102537. Epub 2023 Feb 10. Curr Opin Struct Biol. 2023. PMID: 36774727 Free article. Review.
Chemogenomics approaches for receptor deorphanization and extensions of the chemogenomics concept to phenotypic space.
van der Horst E, Peironcely JE, van Westen GJ, van den Hoven OO, Galloway WR, Spring DR, Wegner JK, van Vlijmen HW, Ijzerman AP, Overington JP, Bender A. van der Horst E, et al. Among authors: van westen gj, van vlijmen hw, van den hoven oo. Curr Top Med Chem. 2011;11(15):1964-77. doi: 10.2174/156802611796391230. Curr Top Med Chem. 2011. PMID: 21470175 Review.
A ligand's-eye view of protein similarity.
van Westen GJ, Overington JP. van Westen GJ, et al. Nat Methods. 2013 Feb;10(2):116-7. doi: 10.1038/nmeth.2339. Nat Methods. 2013. PMID: 23361090 No abstract available.
120 results