Dehabadi, M. H., Caflisch, A., Ilie, I. M., & Firouzi, R. (2022). Interactions of curcumin’s degradation products with the Aβ dimer: a computational study. The Journal of Physical Chemistry B, 126(39), 7627-7637. https://doi.org/10.1021/acs.jpcb.2c05846 (Original work published)

Ilie, I. M., & Caflisch, A. (2018). Disorder at the tips of a disease-relevant Aβ42 amyloid fibril: A molecular dynamics study. The Journal of Physical Chemistry B, 122(49), 11072–11082. https://doi.org/10.1021/acs.jpcb.8b05236 (Original work published)

Attanasio, F., Convertino, M., Magno, A., Caflisch, A., Corazza, A., Haridas, H., … Rizzarelli, E. (2013). Carnosine inhibits Aβ42 aggregation by perturbing the H-bond network in and around the central hydrophobic cluster. ChemBioChem, 14(5), 583-592. https://doi.org/10.1002/cbic.201200704 (Original work published)

Scherzer-Attali, R., Convertino, M., Pellarin, R., Gazit, E., Segal, D., & Caflisch, A. (2013). Methylations of tryptophan-modified naphthoquinone affect its inhibitory potential toward Aβ aggregation. The Journal of Physical Chemistry B, 117(6), 1780-1789. https://doi.org/10.1021/jp309066p (Original work published)

Convertino, M., Vitalis, A., & Caflisch, A. (2011). Disordered binding of small molecules to Aβ(12-28). The Journal of Biological Chemistry, 286(48), 41578-41588. https://doi.org/10.1074/jbc.M111.285957 (Original work published)

Frydman-Marom, A., Convertino, M., Pellarin, R., Lampel, A., Shaltiel-Karyo, R., Segal, D., … Gazit, E. (2011). Structural basis for inhibiting β-amyloid oligomerization by a non-coded β-breaker-substituted endomorphin analogue. ACS Chemical Biology, 6(11), 1265-1276. https://doi.org/10.1021/cb200103h (Original work published)

Vitalis, A., & Caflisch, A. (2010). Micelle-like architecture of the monomer ensemble of Alzheimer’s amyloid-β peptide in aqueous solution and its implications for Aβ aggregation. Journal of Molecular Biology, 403(1), 148-165. https://doi.org/10.1016/j.jmb.2010.08.003 (Original work published)

Convertino, M., Pellarin, R., Catto, M., Carotti, A., & Caflisch, A. (2009). 9,10-Anthraquinone hinders beta-aggregation: How does a small molecule interfere with Abeta-peptide amyloid fibrillation? Protein Science, 18(4), 792-800. https://doi.org/10.1002/pro.87 (Original work published 2009)

Pellarin, R., & Caflisch, A. (2006). Interpreting the aggregation kinetics of amyloid peptides. Journal of Molecular Biology, 360(4), 882-892. https://doi.org/10.1016/j.jmb.2006.05.033 (Original work published)

Cecchini, M., Curcio, R., Pappalardo, M., Melki, R., & Caflisch, A. (2006). A molecular dynamics approach to the structural characterization of amyloid aggregation. Journal of Molecular Biology, 357(4), 1306-1321. https://doi.org/10.1016/j.jmb.2006.01.009 (Original work published)