Barata T - Search Results

1

Structure-activity relationships of monomeric C2-aryl pyrrolo[2,1-c][1,4]benzodiazepine (PBD) antitumor agents.

Antonow D, Kaliszczak M, Kang GD, Coffils M, Tiberghien AC, Cooper N, Barata T, Heidelberger S, James CH, Zloh M, Jenkins TC, Reszka AP, Neidle S, Guichard SM, Jodrell DI, Hartley JA, Howard PW, Thurston DE. Antonow D, et al. Among authors: barata t. J Med Chem. 2010 Apr 8;53(7):2927-41. doi: 10.1021/jm901722v. J Med Chem. 2010. PMID: 20218628

2

Solution structure of a 2:1 C2-(2-naphthyl) pyrrolo[2,1-c][1,4]benzodiazepine DNA adduct: molecular basis for unexpectedly high DNA helix stabilization.

Antonow D, Barata T, Jenkins TC, Parkinson GN, Howard PW, Thurston DE, Zloh M. Antonow D, et al. Among authors: barata t. Biochemistry. 2008 Nov 11;47(45):11818-29. doi: 10.1021/bi801225q. Epub 2008 Oct 17. Biochemistry. 2008. PMID: 18925745

3

Structural studies of biologically active glycosylated polyamidoamine (PAMAM) dendrimers.

Barata TS, Shaunak S, Teo I, Zloh M, Brocchini S. Barata TS, et al. J Mol Model. 2011 Aug;17(8):2051-60. doi: 10.1007/s00894-010-0907-1. Epub 2010 Dec 15. J Mol Model. 2011. PMID: 21161557

4

From sequence to 3D structure of hyperbranched molecules: application to surface modified PAMAM dendrimers.

Barata TS, Brocchini S, Teo I, Shaunak S, Zloh M. Barata TS, et al. J Mol Model. 2011 Nov;17(11):2741-9. doi: 10.1007/s00894-011-0966-y. Epub 2011 Jan 29. J Mol Model. 2011. PMID: 21279526

5

Partially glycosylated dendrimers block MD-2 and prevent TLR4-MD-2-LPS complex mediated cytokine responses.

Barata TS, Teo I, Brocchini S, Zloh M, Shaunak S. Barata TS, et al. PLoS Comput Biol. 2011 Jun;7(6):e1002095. doi: 10.1371/journal.pcbi.1002095. Epub 2011 Jun 30. PLoS Comput Biol. 2011. PMID: 21738462 Free PMC article.

6

Computational design principles for bioactive dendrimer based constructs as antagonists of the TLR4-MD-2-LPS complex.

Barata T, Teo I, Lalwani S, Simanek E, Zloh M, Shaunak S. Barata T, et al. Biomaterials. 2011 Nov;32(33):8702-11. doi: 10.1016/j.biomaterials.2011.07.085. Epub 2011 Aug 23. Biomaterials. 2011. PMID: 21864902 Free PMC article.

7

Target fishing and docking studies of the novel derivatives of aryl-aminopyridines with potential anticancer activity.

Erić S, Ke S, Barata T, Solmajer T, Antić Stanković J, Juranić Z, Savić V, Zloh M. Erić S, et al. Among authors: barata t. Bioorg Med Chem. 2012 Sep 1;20(17):5220-8. doi: 10.1016/j.bmc.2012.06.051. Epub 2012 Jul 11. Bioorg Med Chem. 2012. PMID: 22841617

8

Molecular Modeling to Study Dendrimers for Biomedical Applications.

Martinho N, Florindo H, Silva L, Brocchini S, Zloh M, Barata T. Martinho N, et al. Among authors: barata t. Molecules. 2014 Dec 8;19(12):20424-20467. doi: 10.3390/molecules191220424. Molecules. 2014. PMID: 25493631 Free PMC article. Review.

9

Identification of Protein-Excipient Interaction Hotspots Using Computational Approaches.

Barata TS, Zhang C, Dalby PA, Brocchini S, Zloh M. Barata TS, et al. Int J Mol Sci. 2016 Jun 1;17(6):853. doi: 10.3390/ijms17060853. Int J Mol Sci. 2016. PMID: 27258262 Free PMC article.

10

Practical computational toolkits for dendrimers and dendrons structure design.

Martinho N, Silva LC, Florindo HF, Brocchini S, Barata T, Zloh M. Martinho N, et al. Among authors: barata t. J Comput Aided Mol Des. 2017 Sep;31(9):817-827. doi: 10.1007/s10822-017-0041-6. Epub 2017 Sep 15. J Comput Aided Mol Des. 2017. PMID: 28916961 Free article.

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