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DNA Repair Inhibitors


L.P. Jordheim, K.H. Barakat, L. Heinrich-Balard, E.L. Matera, E. Cros-Perrial, K. Bouledrak, R. El Sabeh, R. Perez-Pineiro, D.S. Wishart, R. Cohen, J. Tuszynski, and C. Dumontet, Small molecule inhibitors of ERCC1-XPF protein-protein interaction synergize alkylating agents in cancer cells, Molecular Pharmacology 84(1):12-24 (2013). doi:10.1124/mol.112.082347

K.H. Barakat, L.P. Jordheim, R. Perez-Pineiro, D. Wishart, C. Dumontet and J.A. Tuszynski, Virtual screening and biological evaluation of inhibitors targeting the XPA-ERCC1 interaction, PLoS One 7(12):e51329 (2012). doi:10.1371/journal.pone.0051329

K. Barakat, B.B. Issack, M. Stepanova and J.A. Tuszynski, Effects of temperature on the p53-DNA binding interactions and their dynamical behavior: Comparing the wild type to the R248Q mutant, PLoS One 6:e27651 (2011). doi:10.1371/journal.pone.0027651

K. Barakat and J.A. Tuszynski, Relaxed complex scheme suggests novel inhibitors for the lyase activity of DNA polymerase beta, Journal of Molecular Graphics and Modelling 29(5):702-716  (2011). doi:10.1016/j.jmgm.2010.12.003

K. Barakat, J. Mane, D. Friesen and J.A. Tuszynski, Ensemble-based virtual screening reveals dual-inhibitors for the p53-MDM2/MDMX interactions, Journal of Molecular Graphics and Modelling 28(6):555-568 (2010). doi:10.1016/j.jmgm.2009.12.003

K. Barakat, J.T. Huzil, C. Dumontet, L. Jordheim and J.A. Tuszynski, Characterization of an Inhibitory Dynamic Pharmacophore for the ERCC1-XPA Interaction Using a Combined Molecular Dynamics and Virtual Screening Approach, Journal of Molecular Graphics and Modelling 28(2):113-130 (2009). doi:10.1016/j.jmgm.2009.04.009