Zalewski A - Search Results

1

Don't Overweight Weights: Evaluation of Weighting Strategies for Multi-Task Bioactivity Classification Models.

Humbeck L, Morawietz T, Sturm N, Zalewski A, Harnqvist S, Heyndrickx W, Holmes M, Beck B. Humbeck L, et al. Among authors: zalewski a. Molecules. 2021 Nov 18;26(22):6959. doi: 10.3390/molecules26226959. Molecules. 2021. PMID: 34834051 Free PMC article.

2

Splitting chemical structure data sets for federated privacy-preserving machine learning.

Simm J, Humbeck L, Zalewski A, Sturm N, Heyndrickx W, Moreau Y, Beck B, Schuffenhauer A. Simm J, et al. Among authors: zalewski a. J Cheminform. 2021 Dec 7;13(1):96. doi: 10.1186/s13321-021-00576-2. J Cheminform. 2021. PMID: 34876230 Free PMC article.

3

A molecular-modeling toolbox aimed at bridging the gap between medicinal chemistry and computational sciences.

Eid S, Zalewski A, Smieško M, Ernst B, Vedani A. Eid S, et al. Among authors: zalewski a. Int J Mol Sci. 2013 Jan 4;14(1):684-700. doi: 10.3390/ijms14010684. Int J Mol Sci. 2013. PMID: 23344039 Free PMC article.

4

Design, synthesis and biological evaluation of mannosyl triazoles as FimH antagonists.

Schwardt O, Rabbani S, Hartmann M, Abgottspon D, Wittwer M, Kleeb S, Zalewski A, Smieško M, Cutting B, Ernst B. Schwardt O, et al. Among authors: zalewski a. Bioorg Med Chem. 2011 Nov 1;19(21):6454-73. doi: 10.1016/j.bmc.2011.08.057. Epub 2011 Aug 31. Bioorg Med Chem. 2011. PMID: 21962988

5

FimH antagonists: structure-activity and structure-property relationships for biphenyl α-D-mannopyranosides.

Pang L, Kleeb S, Lemme K, Rabbani S, Scharenberg M, Zalewski A, Schädler F, Schwardt O, Ernst B. Pang L, et al. Among authors: zalewski a. ChemMedChem. 2012 Aug;7(8):1404-22. doi: 10.1002/cmdc.201200125. Epub 2012 May 29. ChemMedChem. 2012. PMID: 22644941

6

Exploring the free-energy landscape of carbohydrate-protein complexes: development and validation of scoring functions considering the binding-site topology.

Eid S, Saleh N, Zalewski A, Vedani A. Eid S, et al. Among authors: zalewski a. J Comput Aided Mol Des. 2014 Dec;28(12):1191-204. doi: 10.1007/s10822-014-9794-3. Epub 2014 Sep 10. J Comput Aided Mol Des. 2014. PMID: 25205292

7

Mutation of Tyr137 of the universal Escherichia coli fimbrial adhesin FimH relaxes the tyrosine gate prior to mannose binding.

Rabbani S, Krammer EM, Roos G, Zalewski A, Preston R, Eid S, Zihlmann P, Prévost M, Lensink MF, Thompson A, Ernst B, Bouckaert J. Rabbani S, et al. Among authors: zalewski a. IUCrJ. 2017 Jan 1;4(Pt 1):7-23. doi: 10.1107/S2052252516016675. eCollection 2017 Jan 1. IUCrJ. 2017. PMID: 28250938 Free PMC article.

8

The price of flexibility - a case study on septanoses as pyranose mimetics.

Sager CP, Fiege B, Zihlmann P, Vannam R, Rabbani S, Jakob RP, Preston RC, Zalewski A, Maier T, Peczuh MW, Ernst B. Sager CP, et al. Among authors: zalewski a. Chem Sci. 2017 Nov 8;9(3):646-654. doi: 10.1039/c7sc04289b. eCollection 2018 Jan 21. Chem Sci. 2017. PMID: 29629131 Free PMC article.

9

Mechanisms of Nitrosamine Mutagenicity and Their Relationship to Rodent Carcinogenic Potency.

Snodin DJ, Trejo-Martin A, Ponting DJ, Smith GF, Czich A, Cross K, Custer L, Elloway J, Greene N, Kalgutkar AS, Stalford SA, Tennant RE, Vock E, Zalewski A, Ziegler V, Dobo KL. Snodin DJ, et al. Among authors: zalewski a. Chem Res Toxicol. 2024 Feb 19;37(2):181-198. doi: 10.1021/acs.chemrestox.3c00327. Epub 2024 Feb 5. Chem Res Toxicol. 2024. PMID: 38316048 Review.

10

Mechanism of the Dual Activities of Human CYP17A1 and Binding to Anti-Prostate Cancer Drug Abiraterone Revealed by a Novel V366M Mutation Causing 17,20 Lyase Deficiency.

Fernández-Cancio M, Camats N, Flück CE, Zalewski A, Dick B, Frey BM, Monné R, Torán N, Audí L, Pandey AV. Fernández-Cancio M, et al. Among authors: zalewski a. Pharmaceuticals (Basel). 2018 Apr 29;11(2):37. doi: 10.3390/ph11020037. Pharmaceuticals (Basel). 2018. PMID: 29710837 Free PMC article.

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My NCBI Filters

Text availability

Article attribute

Article type

Publication date

267 results

Search Page