Issue Date | Title | Author(s) | Source | WOS | Fulltext/Archive link |
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2019 | Application of Bioactivity Profile-Based Fingerprints for Building Machine Learning Models | Sturm, N.; Sun, J. M.; Vandriessche, Y.; Mayr, A.; Klambauer, G.; Carlsson, L.; Engkvist, O.; Hong-Ming Chen | Journal of Chemical Information and Modeling | ||
2020 | Industry-scale application and evaluation of deep learning for drug target prediction | Sturm, N.; Mayr, A.; Van, T. L.; Chupakhin, V.; Ceulemans, H.; Wegner, J.; Golib-Dzib, J. F.; Jeliazkova, N.; Vandriessche, Y.; Bohm, S.; Cima, V.; Martinovic, J.; Greene, N.; Vander Aa, T.; Ashby, T. J.; Hochreiter, S.; Engkvist, O.; Klambauer, G.; Hong-Ming Chen | Journal of Cheminformatics |