Publisher
Springer Science and Business Media LLC
Subject
Artificial Intelligence,Computer Networks and Communications,Computer Vision and Pattern Recognition,Human-Computer Interaction,Software
Reference57 articles.
1. Rogers, D. & Hahn, M. Extended-connectivity fingerprints. J. Chem. Inf. Model. 50, 742–754 (2010).
2. Rupp, M., Tkatchenko, A., Müller, K.-R. & Von Lilienfeld, O. A. Fast and accurate modeling of molecular atomization energies with machine learning. Phys. Rev. Lett. 108, 058301 (2012).
3. Weininger, D. SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules. J. Chem. Inf. Comput. Sci. 28, 31–36 (1988).
4. Goh, G. B., Hodas, N. O., Siegel, C. & Vishnu, A. SMILES2Vec: an interpretable general-purpose deep neural network for predicting chemical properties. Preprint at https://arxiv.org/abs/1712.02034 (2017).
5. Öztürk, H., Özgür, A. & Ozkirimli, E. DeepDTA: deep drug–target binding affinity prediction. Bioinformatics 34, i821–i829 (2018).
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