Expanding Chemical Representation with k-mers and Fragment-Based Fingerprints for Molecular Fingerprinting
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Publisher
Springer Nature Switzerland
Link
https://link.springer.com/content/pdf/10.1007/978-3-031-63616-5_2
Reference32 articles.
1. Awale, M., Reymond, J.L.: A multi-fingerprint browser for the zinc database. Nucleic Acids Res. 42(W1), W234–W239 (2014)
2. Chen, H., Engkvist, O., Wang, Y., Olivecrona, M., Blaschke, T.: The rise of deep learning in drug discovery. Drug Discovery Today 23(6), 1241–1250 (2018)
3. Chen, H., Kogej, T., Engkvist, O.: Cheminformatics in drug discovery, an industrial perspective. Mol. Inf. 37(9–10), 1800041 (2018)
4. Choi, Y., Shin, et al.: Target-centered drug repurposing predictions of human angiotensin-converting enzyme 2 (ace2) and transmembrane protease serine subtype 2 (tmprss2) interacting approved drugs for coronavirus disease 2019 (covid-19) treatment through a drug-target interaction deep learning model. Viruses 12(11), 1325 (2020)
5. Durant, J.L., Leland, B.A., Henry, D.R., Nourse, J.G.: Reoptimization of mdl keys for use in drug discovery. J. Chem. Inf. Comput. Sci. 42(6), 1273–1280 (2002)
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