Telomere structure and stability: covalency in hydrogen bonds, not resonance assistance, causes cooperativity in guanine quartets C Fonseca Guerra, H Zijlstra, G Paragi, FM Bickelhaupt Chemistry-A European Journal 17 (45), 12612-12622, 2011 | 162 | 2011 |
The role of alkali metal cations in the stabilization of guanine quadruplexes: why K+ is the best F Zaccaria, G Paragi, CF Guerra Physical Chemistry Chemical Physics 18 (31), 20895-20904, 2016 | 95 | 2016 |
The impact of molecular dynamics sampling on the performance of virtual screening against GPCRs Á Tarcsay, G Paragi, M Vass, B Jójárt, F Bogár, GM Keserű Journal of chemical information and modeling 53 (11), 2990-2999, 2013 | 64 | 2013 |
The Role of Lipids and Membranes in the Pathogenesis of Alzheimer's Disease: A Comprehensive View. B Penke, G Paragi, J Gera, R Berkecz, Z Kovács, T Crul, L Vígh Current Alzheimer research, 2018 | 48 | 2018 |
Key Peptides and Proteins in Alzheimer’s Disease B Penke, F Bogár, G Paragi, J Gera, L Fülöp Current Protein and Peptide Science 20 (6), 577-599, 2019 | 46 | 2019 |
3-Substituted xanthines as promising candidates for quadruplex formation: computational, synthetic and analytical studies J Szolomájer, G Paragi, G Batta, CF Guerra, FM Bickelhaupt, Z Kele, ... New Journal of Chemistry 35 (2), 476-482, 2011 | 43 | 2011 |
Combination of a modified scoring function with two-dimensional descriptors for calculation of binding affinities of bulky, flexible ligands to proteins C Hetényi, G Paragi, U Maran, Z Timár, M Karelson, B Penke Journal of the American Chemical Society 128 (4), 1233-1239, 2006 | 41 | 2006 |
Cooperativity in the Self‐Assembly of the Guanine Nucleobase into Quartet and Ribbon Structures on Surfaces G Paragi, C Fonseca Guerra Chemistry-A European Journal 23 (13), 3042-3050, 2017 | 33 | 2017 |
Halogen Bonds in Ligand–Protein Systems: Molecular Orbital Theory for Drug Design E Margiotta, SCC van der Lubbe, L de Azevedo Santos, G Paragi, S Moro, ... Journal of chemical information and modeling 60 (3), 1317-1328, 2020 | 32 | 2020 |
Single Diastereomers of Polyhydroxylated 9-Oxa-1-azabicyclo [4.2. 1] nonanes from Intramolecular 1, 3-Dipolar Cycloaddition of ω-Unsaturated Nitrones P Pádár, A Bokros, G Paragi, P Forgó, Z Kele, NM Howarth, L Kovács The Journal of organic chemistry 71 (22), 8669-8672, 2006 | 29 | 2006 |
Studying the structural properties of polyalanine and polyglutamine peptides B Leitgeb, Á Kerényi, F Bogár, G Paragi, B Penke, G Rákhely Journal of Molecular Modeling 13, 1141-1150, 2007 | 28 | 2007 |
Effects of the Level of Electronic Structure Theory on the Dynamics of the F– + CH3I Reaction T Győri, B Olasz, G Paragi, G Czakó The Journal of Physical Chemistry A 122 (13), 3353-3364, 2018 | 25 | 2018 |
Neutral and positively charged new purine tetramer structures: a computational study of xanthine and uric acid derivatives G Paragi, L Kovács, Z Kupihár, J Szolomájer, B Penke, CF Guerra, ... New Journal of Chemistry 35 (1), 119-126, 2011 | 24 | 2011 |
Supramolecular H-bonded porous networks at surfaces: exploiting primary and secondary interactions in a bi-component melamine–xanthine system A Ciesielski, S Haar, G Paragi, Z Kupihár, Z Kele, S Masiero, CF Guerra, ... Physical Chemistry Chemical Physics 15 (30), 12442-12446, 2013 | 23 | 2013 |
Discovering the chloride pathway in the CFTR channel B Farkas, H Tordai, R Padányi, A Tordai, J Gera, G Paragi, T Hegedűs Cellular and Molecular Life Sciences 77, 765-778, 2020 | 21 | 2020 |
Hydrogen bonding of 3-and 5-methyl-6-aminouracil with natural DNA bases G Paragi, E Szájli, F Bogár, L Kovács, CF Guerra, FM Bickelhaupt New Journal of Chemistry 32 (11), 1981-1987, 2008 | 19 | 2008 |
Self-assembly of n3-substituted xanthines in the solid state and at the solid–liquid interface A Ciesielski, S Haar, A Bényei, G Paragi, CF Guerra, FM Bickelhaupt, ... Langmuir 29 (24), 7283-7290, 2013 | 17 | 2013 |
Computational understanding and experimental characterization of twice-as-smart quadruplex ligands as chemical sensors of bacterial nucleotide second messengers J Zhou, BT Roembke, G Paragi, A Laguerre, HO Sintim, ... Scientific Reports 6, 33888, 2016 | 16 | 2016 |
Thermodynamic and kinetic insights into the interaction of kynurenic acid with human serum albumin: Spectroscopic and calorimetric approaches V Hornok, Á Juhász, G Paragi, AN Kovács, E Csapó Journal of Molecular Liquids 313, 112869, 2020 | 15 | 2020 |
Flow-chemistry enabled efficient synthesis of β-peptides: backbone topology vs. helix formation I Nekkaa, D Bogdán, T Gáti, S Béni, T Juhász, M Palkó, G Paragi, GK Tóth, ... Chemical Communications 55 (21), 3061-3064, 2019 | 15 | 2019 |