staff:gergely.kohut

Gergely Kohut

Research group	Beke-Somfai Lab: Biomolecular Self-Assembly
Role	Alumni
MTMT	10062682

Controlling Peptide Function by Directed Assembly Formation: Mechanistic Insights Using Multiscale Modeling on an Antimicrobial Peptide–Drug–Membrane System (2021)
Gergely Kohut, Tünde Juhász, Mayra Quemé-Peña, Szilvia Erika Bősze, Tamás Beke-Somfai ACS Omega 6/24 p15756-15769
American Chemical Society (ACS) DOI:10.1021/acsomega.1c01114
Membrane Association Modes of Natural Anticancer Peptides: Mechanistic Details on Helicity, Orientation, and Surface Coverage (2021)
Mayra Quemé-Peña, Tünde Juhász, Gergely Kohut, Maria Ricci, Priyanka Singh, Imola Cs. Szigyártó, Zita I. Papp, Lívia Fülöp, Tamás Beke-Somfai International Journal of Molecular Sciences 22/16 p8613
MDPI AG DOI:10.3390/ijms22168613

Membrane active Janus-oligomers of β<sup>3</sup>-peptides (2020)
Imola Cs. Szigyártó, Judith Mihály, András Wacha, Dóra Bogdán, Tünde Juhász, Gergely Kohut, Gitta Schlosser, Ferenc Zsila, Vlada Urlacher, Zoltán Varga, Ferenc Fülöp, Attila Bóta, István Mándity, Tamás Beke-Somfai Chemical Science 11/26 p6868-6881
Royal Society of Chemistry (RSC) DOI:10.1039/d0sc01344g

Disorder-to-helix conformational conversion of the human immunomodulatory peptide LL-37 induced by antiinflammatory drugs, food dyes and some metabolites (2019)
Ferenc Zsila, Gergely Kohut, Tamás Beke-Somfai International Journal of Biological Macromolecules 129 p50-60
Elsevier BV DOI:10.1016/j.ijbiomac.2019.01.209
The molecular mechanism of structural changes in the antimicrobial peptide CM15 upon complex formation with drug molecule suramin: a computational analysis (2019)
Gergely Kohut, Adam Sieradzan, Ferenc Zsila, Tünde Juhász, Szilvia Bősze, Adam Liwo, Sergey A. Samsonov, Tamás Beke-Somfai Physical Chemistry Chemical Physics 21/20 p10644-10659
Royal Society of Chemistry (RSC) DOI:10.1039/c9cp00471h
Analysis of Procollagen C-Proteinase Enhancer-1/Glycosaminoglycan Binding Sites and of the Potential Role of Calcium Ions in the Interaction (2019)
Jan Potthoff, Krzysztof K. Bojarski, Gergely Kohut, Agnieszka G. Lipska, Adam Liwo, Efrat Kessler, Sylvie Ricard-Blum, Sergey A. Samsonov International Journal of Molecular Sciences 20/20 p5021
MDPI AG DOI:10.3390/ijms20205021

Heparin and Heparan Sulfate Binding of the Antiparasitic Drug Imidocarb: Circular Dichroism Spectroscopy, Isothermal Titration Calorimetry, and Computational Studies (2018)
Ferenc Zsila, Tünde Juhász, Gergely Kohut, Tamás Beke-Somfai The Journal of Physical Chemistry B 122/6 p1781-1791
American Chemical Society (ACS) DOI:10.1021/acs.jpcb.7b08876
The lipid mediator lysophosphatidic acid induces folding of disordered peptides with basic amphipathic character into rare conformations (2018)
Tünde Juhász, Judith Mihály, Gergely Kohut, Csaba Németh, Károly Liliom, Tamás Beke-Somfai Scientific Reports 8/1
Springer Science and Business Media LLC DOI:10.1038/s41598-018-32786-4
Protein–Ligand Interaction Energy-Based Entropy Calculations: Fundamental Challenges For Flexible Systems (2018)
Gergely Kohut, Adam Liwo, Szilvia Bősze, Tamás Beke-Somfai, Sergey A. Samsonov The Journal of Physical Chemistry B 122/32 p7821-7827
American Chemical Society (ACS) DOI:10.1021/acs.jpcb.8b03658