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Items: 9


Tubulin response to intense nanosecond-scale electric field in molecular dynamics simulation.

Marracino P, Havelka D, Průša J, Liberti M, Tuszynski J, Ayoub AT, Apollonio F, Cifra M.

Sci Rep. 2019 Jul 19;9(1):10477. doi: 10.1038/s41598-019-46636-4.


Modeling the Colchicum autumnale Tubulin and a Comparison of Its Interaction with Colchicine to Human Tubulin.

Spasevska I, Ayoub AT, Winter P, Preto J, Wong GK, Dumontet C, Tuszynski JA.

Int J Mol Sci. 2017 Aug 2;18(8). pii: E1676. doi: 10.3390/ijms18081676.


Chemical synthesis, pharmacological evaluation and in silico analysis of new 2,3,3a,4,5,6-hexahydrocyclopenta[c]pyrazole derivatives as potential anti-mitotic agents.

Minu M, Singh D, Mahaddalkar T, Lopus M, Winter P, Ayoub AT, Missiaen K, Tilli TM, Pasdar M, Tuszynski J.

Bioorg Med Chem Lett. 2016 Aug 15;26(16):3855-61. doi: 10.1016/j.bmcl.2016.07.025. Epub 2016 Jul 9.


Designing and Testing of Novel Taxanes to Probe the Highly Complex Mechanisms by Which Taxanes Bind to Microtubules and Cause Cytotoxicity to Cancer Cells.

St George M, Ayoub AT, Banerjee A, Churchill CD, Winter P, Klobukowski M, Cass CE, Ludueña RF, Tuszynski JA, Damaraju S.

PLoS One. 2015 Jun 8;10(6):e0129168. doi: 10.1371/journal.pone.0129168. eCollection 2015.


Detailed Per-residue Energetic Analysis Explains the Driving Force for Microtubule Disassembly.

Ayoub AT, Klobukowski M, Tuszynski JA.

PLoS Comput Biol. 2015 Jun 1;11(6):e1004313. doi: 10.1371/journal.pcbi.1004313. eCollection 2015 Jun.


Anesthetics act in quantum channels in brain microtubules to prevent consciousness.

Craddock TJ, Hameroff SR, Ayoub AT, Klobukowski M, Tuszynski JA.

Curr Top Med Chem. 2015;15(6):523-33.


Analysis of the strength of interfacial hydrogen bonds between tubulin dimers using quantum theory of atoms in molecules.

Ayoub AT, Craddock TJA, Klobukowski M, Tuszynski J.

Biophys J. 2014 Aug 5;107(3):740-750. doi: 10.1016/j.bpj.2014.05.047.


Similarity-based virtual screening for microtubule stabilizers reveals novel antimitotic scaffold.

Ayoub AT, Klobukowski M, Tuszynski J.

J Mol Graph Model. 2013 Jul;44:188-96. doi: 10.1016/j.jmgm.2013.05.008. Epub 2013 Jun 25.


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