Dyubankova N - Search Results

1

Global reactivity models are impactful in industrial synthesis applications.

Neves P, McClure K, Verhoeven J, Dyubankova N, Nugmanov R, Gedich A, Menon S, Shi Z, Wegner JK. Neves P, et al. Among authors: dyubankova n. J Cheminform. 2023 Feb 11;15(1):20. doi: 10.1186/s13321-023-00685-0. J Cheminform. 2023. PMID: 36774523 Free PMC article.

2

Atom-to-atom Mapping: A Benchmarking Study of Popular Mapping Algorithms and Consensus Strategies.

Lin A, Dyubankova N, Madzhidov TI, Nugmanov RI, Verhoeven J, Gimadiev TR, Afonina VA, Ibragimova Z, Rakhimbekova A, Sidorov P, Gedich A, Suleymanov R, Mukhametgaleev R, Wegner J, Ceulemans H, Varnek A. Lin A, et al. Among authors: dyubankova n. Mol Inform. 2022 Apr;41(4):e2100138. doi: 10.1002/minf.202100138. Epub 2021 Nov 2. Mol Inform. 2022. PMID: 34726834 Free article.

3

Improving Few- and Zero-Shot Reaction Template Prediction Using Modern Hopfield Networks.

Seidl P, Renz P, Dyubankova N, Neves P, Verhoeven J, Wegner JK, Segler M, Hochreiter S, Klambauer G. Seidl P, et al. Among authors: dyubankova n. J Chem Inf Model. 2022 May 9;62(9):2111-2120. doi: 10.1021/acs.jcim.1c01065. Epub 2022 Jan 15. J Chem Inf Model. 2022. PMID: 35034452 Free PMC article. Review.

4

Bidirectional Graphormer for Reactivity Understanding: Neural Network Trained to Reaction Atom-to-Atom Mapping Task.

Nugmanov R, Dyubankova N, Gedich A, Wegner JK. Nugmanov R, et al. Among authors: dyubankova n. J Chem Inf Model. 2022 Jul 25;62(14):3307-3315. doi: 10.1021/acs.jcim.2c00344. Epub 2022 Jul 6. J Chem Inf Model. 2022. PMID: 35792579 Review.

5

Correction: Global reactivity models are impactful in industrial synthesis applications.

Neves P, McClure K, Verhoeven J, Dyubankova N, Nugmanov R, Gedich A, Menon S, Shi Z, Wegner JK. Neves P, et al. Among authors: dyubankova n. J Cheminform. 2023 Mar 2;15(1):30. doi: 10.1186/s13321-023-00705-z. J Cheminform. 2023. PMID: 36864495 Free PMC article. No abstract available.

6

Probing machine learning models based on high throughput experimentation data for the discovery of asymmetric hydrogenation catalysts.

Kalikadien AV, Valsecchi C, van Putten R, Maes T, Muuronen M, Dyubankova N, Lefort L, Pidko EA. Kalikadien AV, et al. Among authors: dyubankova n. Chem Sci. 2024 Jul 16;15(34):13618-13630. doi: 10.1039/d4sc03647f. eCollection 2024 Aug 28. Chem Sci. 2024. PMID: 39211503 Free PMC article.

7

NMR study on the interaction of the conserved CREX 'stem-loop' in the Hepatitis E virus genome with a naphthyridine-based ligand.

Dyubankova N, Froeyen M, Abramov M, Mattelaer HP, Herdewijn P, Lescrinier E. Dyubankova N, et al. Org Biomol Chem. 2015 Oct 7;13(37):9665-72. doi: 10.1039/c5ob01381j. Org Biomol Chem. 2015. PMID: 26264660

8

Contribution of dihydrouridine in folding of the D-arm in tRNA.

Dyubankova N, Sochacka E, Kraszewska K, Nawrot B, Herdewijn P, Lescrinier E. Dyubankova N, et al. Org Biomol Chem. 2015 May 7;13(17):4960-6. doi: 10.1039/c5ob00164a. Org Biomol Chem. 2015. PMID: 25815904

9

Synthesis and biological evaluation of 68Ga-bis-DOTA-PA as a potential agent for positron emission tomography imaging of necrosis.

Prinsen K, Cona MM, Cleynhens BJ, Li J, Vanbilloen H, Dyubankova N, Lescrinier E, Ni Y, Bormans GM, Verbruggen AM. Prinsen K, et al. Among authors: dyubankova n. Nucl Med Biol. 2013 Aug;40(6):816-22. doi: 10.1016/j.nucmedbio.2013.04.011. Nucl Med Biol. 2013. PMID: 23915800

10

Synthesis and biological evaluation of 68Ga labeled bis-DOTA-3,3'-(benzylidene)-bis-(1H-indole-2-carbohydrazide) as a PET tracer for in vivo visualization of necrosis.

Prinsen K, Cona MM, Cleynhens J, Vanbilloen H, Li J, Dyubankova N, Lescrinier E, Bormans G, Ni Y, Verbruggen A. Prinsen K, et al. Among authors: dyubankova n. Bioorg Med Chem Lett. 2013 Jun 1;23(11):3216-20. doi: 10.1016/j.bmcl.2013.03.127. Epub 2013 Apr 9. Bioorg Med Chem Lett. 2013. PMID: 23635829

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