Tuszynski JA - Search Results

1

Computer-aided drug design of small molecule inhibitors of the ERCC1-XPF protein-protein interaction.

Gentile F, Elmenoufy AH, Ciniero G, Jay D, Karimi-Busheri F, Barakat KH, Weinfeld M, West FG, Tuszynski JA. Gentile F, et al. Among authors: tuszynski ja. Chem Biol Drug Des. 2020 Apr;95(4):460-471. doi: 10.1111/cbdd.13660. Epub 2020 Jan 20. Chem Biol Drug Des. 2020. PMID: 31891209

2

Characterization of an inhibitory dynamic pharmacophore for the ERCC1-XPA interaction using a combined molecular dynamics and virtual screening approach.

Barakat KH, Torin Huzil J, Luchko T, Jordheim L, Dumontet C, Tuszynski J. Barakat KH, et al. J Mol Graph Model. 2009 Sep;28(2):113-30. doi: 10.1016/j.jmgm.2009.04.009. Epub 2009 May 4. J Mol Graph Model. 2009. PMID: 19473860

3

Electrostatic contributions to colchicine binding within tubulin isotypes.

Huzil JT, Barakat K, Tuszynski JA. Huzil JT, et al. Among authors: tuszynski ja. Electromagn Biol Med. 2009;28(4):355-64. doi: 10.3109/15368370903206606. Electromagn Biol Med. 2009. PMID: 20017626

4

Ensemble-based virtual screening reveals dual-inhibitors for the p53-MDM2/MDMX interactions.

Barakat K, Mane J, Friesen D, Tuszynski J. Barakat K, et al. J Mol Graph Model. 2010 Feb 26;28(6):555-68. doi: 10.1016/j.jmgm.2009.12.003. Epub 2009 Dec 14. J Mol Graph Model. 2010. PMID: 20056466

5

Computational design and biological testing of highly cytotoxic colchicine ring A modifications.

Torin Huzil J, Winter P, Johnson L, Weis AL, Bakos T, Banerjee A, Luduena RF, Damaraju S, Tuszynski JA. Torin Huzil J, et al. Among authors: tuszynski ja. Chem Biol Drug Des. 2010 Jun;75(6):541-50. doi: 10.1111/j.1747-0285.2010.00970.x. Epub 2010 Apr 8. Chem Biol Drug Des. 2010. PMID: 20408852

6

Discovery and characterization of the laulimalide-microtubule binding mode by mass shift perturbation mapping.

Bennett MJ, Barakat K, Huzil JT, Tuszynski J, Schriemer DC. Bennett MJ, et al. Chem Biol. 2010 Jul 30;17(7):725-34. doi: 10.1016/j.chembiol.2010.05.019. Chem Biol. 2010. PMID: 20659685

7

Relaxed complex scheme suggests novel inhibitors for the lyase activity of DNA polymerase beta.

Barakat K, Tuszynski J. Barakat K, et al. J Mol Graph Model. 2011 Feb;29(5):702-16. doi: 10.1016/j.jmgm.2010.12.003. Epub 2010 Dec 13. J Mol Graph Model. 2011. PMID: 21194999

8

Entropic fragment-based approach to aptamer design.

Tseng CY, Ashrafuzzaman M, Mane JY, Kapty J, Mercer JR, Tuszynski JA. Tseng CY, et al. Among authors: tuszynski ja. Chem Biol Drug Des. 2011 Jul;78(1):1-13. doi: 10.1111/j.1747-0285.2011.01125.x. Epub 2011 May 25. Chem Biol Drug Des. 2011. PMID: 21496214

9

Determination of noscapine's localization and interaction with the tubulin-α/β heterodimer.

Alisaraie L, Tuszynski JA. Alisaraie L, et al. Among authors: tuszynski ja. Chem Biol Drug Des. 2011 Oct;78(4):535-46. doi: 10.1111/j.1747-0285.2011.01189.x. Epub 2011 Sep 6. Chem Biol Drug Des. 2011. PMID: 21781284

10

Effects of temperature on the p53-DNA binding interactions and their dynamical behavior: comparing the wild type to the R248Q mutant.

Barakat K, Issack BB, Stepanova M, Tuszynski J. Barakat K, et al. PLoS One. 2011;6(11):e27651. doi: 10.1371/journal.pone.0027651. Epub 2011 Nov 16. PLoS One. 2011. PMID: 22110706 Free PMC article.

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