Solvation model induced structural changes in peptides. A quantum chemical study on Ramachandran surfaces and conformers of alanine diamide using the polarizable continuum model. - Ilona Hudáky; Péter Hudáky; András Perczel (J. Comput. Chem., 2004)

Local protein backbone folds determined by calculated NMR chemical shifts. - András Czajlik; Ilona Hudáky; András Perczel (J. Comput. Chem., 2011)

Predictable Conformational Diversity in Foldamers of Sugar Amino Acids. - Dóra K. Menyhárd; Ilona Hudáky; Imre Jákli; György Juhász; András Perczel (J. Chem. Inf. Model., 2017)