L. Tóth

The Effect of Newly Developed OPLS-AA Alanyl Radical Parameters on Peptide Secondary Structure.

I. Komáromi, B. Viskolcz, I. Csizmadia, 2012, Journal of chemical theory and computation.

Preparation of neuroprotective condensed 1,4-benzoxazepines by regio- and diastereoselective domino Knoevenagel–[1,5]-hydride shift cyclization reaction

P. Mátyus, B. Balogh, K. Kövér, 2014, Beilstein journal of organic chemistry.

Vibrational and electronic circular dichroism studies on the axially chiral pyridine-N-oxide: trans-2,6-di-ortho-tolyl-3,4,5-trimethylpyridine-N-oxide

P. Filip, A. Mándi, T. Kurtán, 2015 .

Dynamic properties of the native free antithrombin from molecular dynamics simulations: computational evidence for solvent- exposed Arg393 side chain

G. Balogh, I. Komáromi, Z. Bereczky, 2015, Journal of biomolecular structure & dynamics.

Mechanism of the irreversible inhibition of human cyclooxygenase-1 by aspirin as predicted by QM/MM calculations.

I. Komáromi, L. Muszbek, L. Tóth, 2013, Journal of molecular graphics & modelling.

[1,5]-Hydride Shift-Cyclization versus C(sp2)-H Functionalization in the Knoevenagel-Cyclization Domino Reactions of 1,4- and 1,5-Benzoxazepines

P. Mátyus, A. Mándi, T. Kurtán, 2020, Molecules.

HPLC-ECD and TDDFT-ECD study of hexahydropyrrolo[1,2-a]quinoline derivatives.

P. Mátyus, A. Mándi, T. Kurtán, 2018, Chirality.