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Machine Learning Models Identify Inhibitors of SARS-CoV-2.
J Chem Inf Model. 2021 Sep 27;61(9):4224-4235. doi: 10.1021/acs.jcim.1c00683. Epub 2021 Aug 13.
J Chem Inf Model. 2021.
PMID: 34387990
Free PMC article.
Cheminformatics Analysis and Modeling with MacrolactoneDB.
Zin PPK, Williams GJ, Ekins S.
Zin PPK, et al.
Sci Rep. 2020 Apr 14;10(1):6284. doi: 10.1038/s41598-020-63192-4.
Sci Rep. 2020.
PMID: 32286395
Free PMC article.
Item in Clipboard
Cheminformatics-based enumeration and analysis of large libraries of macrolide scaffolds.
Zin PPK, Williams G, Fourches D.
Zin PPK, et al.
J Cheminform. 2018 Nov 12;10(1):53. doi: 10.1186/s13321-018-0307-6.
J Cheminform. 2018.
PMID: 30421084
Free PMC article.
Item in Clipboard
SIME: synthetic insight-based macrolide enumerator to generate the V1B library of 1 billion macrolides.
Zin PPK, Williams G, Fourches D.
Zin PPK, et al.
J Cheminform. 2020 Apr 10;12(1):23. doi: 10.1186/s13321-020-00427-6.
J Cheminform. 2020.
PMID: 33431002
Free PMC article.
Item in Clipboard
Paths to cheminformatics: Q&A with Phyo Phyo Kyaw Zin.
Zin PPK.
Zin PPK.
J Cheminform. 2023 Feb 13;15(1):21. doi: 10.1186/s13321-022-00668-7.
J Cheminform. 2023.
PMID: 36782266
Free PMC article.
No abstract available.
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Structural-based connectivity and omic phenotype evaluations (SCOPE): a cheminformatics toolbox for investigating lipidomic changes in complex systems.
Odenkirk MT , Zin PPK , Ash JR , Reif DM , Fourches D , Baker ES .
Odenkirk MT , et al. Among authors: zin ppk.
Analyst. 2020 Nov 9;145(22):7197-7209. doi: 10.1039/d0an01638a.
Analyst. 2020.
PMID: 33094747
Free PMC article.
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