Balázs Jójárt: search on Z-Library

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1

Mixed Micelles of Sodium Cholate and Sodium Dodecylsulphate 1:1 Binary Mixture at Different Temperatures – Experimental and Theoretical Investigations

Jójárt, Balázs, Poša, Mihalj, Fiser, Béla, Szőri, Milán, Farkaš, Zita, Viskolcz, Béla, Roccatano, Danilo

Journal:

Year:

2014

Language:

english

File:

PDF, 1.36 MB

english, 2014

2

Properties of the intrinsic surface of liquid acetone, as seen from computer simulations

Jedlovszky, Pál, Jójárt, Balázs, Horvai, George

Journal:

Molecular Physics

Year:

2015

Language:

english

File:

PDF, 809 KB

english, 2015

3

β2-Adrenergic activity of 6-methoxykaempferol-3-O-glucoside on rat uterus: In vitro and in silico studies

Aimun A.E. Ahmed, Arpad Marki, Robert Gaspar, Andrea Vasas, M.M.E. Mudawi, Judit Verli, Balázs Jójárt, Judit Hohmann, George Falkay

Journal:

European Journal of Pharmacology

Year:

2011

Language:

english

File:

PDF, 1.04 MB

english, 2011

4

3D QSAR models for α2a-adrenoceptor agonists

Balázs Balogh, Balázs Jójárt, Zsolt Wágner, Péter Kovács, Gáspár Máté, Klára Gyires, Zoltán Zádori, György Falkay, Árpád Márki, Béla Viskolcz, Péter Mátyus

Journal:

Neurochemistry International

Year:

2007

Language:

english

File:

PDF, 704 KB

english, 2007

5

Properties of the Liquid–Vapor Interface of Acetone–Water Mixtures. A Computer Simulation and ITIM Analysis Study

Fábián, Balázs, Jójárt, Balázs, Horvai, George, Jedlovszky, Pál

Journal:

The Journal of Physical Chemistry C

Year:

2015

Language:

english

File:

PDF, 3.98 MB

english, 2015

6

Oxidatively-Mediated in Silico Epimerization of a Highly Amyloidogenic Segment in the Human Calcitonin Hormone (hCT15-19)

Hamid, Ahmad Kamal M., Salvatore, Joanna C., Wang, Ke, Murahari, Prashantha, Guljas, Andrea, Rágyanszki, Anita, Owen, Michael, Jójárt, Balázs, Szőri, Milán, Csizmadia, Imre G., Viskolcz, Béla, Fiser,

Journal:

Computational Biology and Chemistry

Year:

2019

File:

PDF, 1.48 MB

2019

7

Comparative study of eight oxytocin antagonists by simulated annealing

Balázs Jójárt, Árpád Márki

Journal:

Journal of Molecular Modeling

Year:

2006

Language:

english

File:

PDF, 244 KB

english, 2006

8

The 3D Structure of the Binding Pocket of the Human Oxytocin Receptor for Benzoxazine Antagonists, Determined by Molecular Docking, Scoring Functions and 3D-QSAR Methods

Balázs Jójárt, Tamás A. Martinek, Árpád Márki

Journal:

Journal of Computer-Aided Molecular Design

Year:

2005

Language:

english

File:

PDF, 552 KB

english, 2005

9

Structural features of human DJ-1 in distinct Cys106 oxidative states and their relevance to its loss of function in disease

Kiss, Róbert, Zhu, Max, Jójárt, Balázs, Czajlik, András, Solti, Katalin, Fórizs, Balázs, Nagy, Éva, Zsila, Ferenc, Beke-Somfai, Tamás, Tóth, Gergely

Journal:

Biochimica et Biophysica Acta (BBA) - General Subjects

Year:

2017

Language:

english

File:

PDF, 1.63 MB

english, 2017

10

Glutathione – Hydroxyl Radical Interaction: A Theoretical Study on Radical Recognition Process

Fiser, Béla, Jójárt, Balázs, Csizmadia, Imre G., Viskolcz, Béla, Soares, Claudio M.

Journal:

Year:

2013

Language:

english

File:

PDF, 2.42 MB

english, 2013

11

Conformational and thermodynamic analysis of the COXIB scaffold using quantum chemical calculations

Michael C. Owen, Milán Szó´ri, Balázs Jojárt, Bela Viskolcz, Imre G. Csizmadia

Journal:

International Journal of Quantum Chemistry

Year:

2012

Language:

english

File:

PDF, 802 KB

english, 2012

12

In silicoand in vitro pharmacological investigations of a natural alkaloid

Aimun A. E. Ahmed, Arpad Marki, Robert Gaspar, Andrea Vasas, M. M. E. Mudawi, Balázs Jójárt, Renáta Minorics, Judit Hohmann, George Falkay

Journal:

Medicinal Chemistry Research

Year:

2012

Language:

english

File:

PDF, 456 KB

english, 2012

13

Effects of polymers on the crystallinity of nanonized meloxicam during a co-grinding process

Mártha, Csaba, Kürti, Levente, Farkas, Gabriella, Jójárt-Laczkovich, Orsolya, Szalontai, Balázs, Glässer, Erik, Deli, Mária A., Szabó-Révész, Piroska

Journal:

European Polymer Journal

Year:

2013

Language:

english

File:

PDF, 1.71 MB

english, 2013

14

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

Owen, Michael C., Tóth, László, Jojárt, Balázs, Komáromi, István, Csizmadia, Imre G., Viskolcz, Bela

Journal:

Journal of Chemical Theory and Computation

Year:

2012

Language:

english

File:

PDF, 2.41 MB

english, 2012

15

Glutathione as a Prebiotic Answer to α-Peptide Based Life

Fiser, Béla, Jójárt, Balázs, Szőri, Milán, Lendvay, György, Csizmadia, Imre G., Viskolcz, Béla

Journal:

Journal of Physical Chemistry B

Year:

2015

Language:

english

File:

PDF, 2.24 MB

english, 2015

16

A computational study of glutathione and its fragments: N-acetylcisteinylglycine and γ-glutamylmethylamide

Vanna Z.Y. Ding, Sean S.H. Dawson, Lewis W.Y. Lau, DongJin R. Lee, Natalie J. Galant, David H. Setiadi, Balázs Jójárt, Milán Szöri, Zoltán Mucsi, Béla Viskolcz, Svend J. Knak Jensen, Imre G. Csizmadia

Journal:

Chemical Physics Letters

Year:

2011

Language:

english

File:

PDF, 937 KB

english, 2011

17

Global optimization of cholic acid aggregates

Jójárt, Balázs, Viskolcz, Béla, Poša, Mihalj, Fejer, Szilard N.

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 748 KB

english, 2014

18

Possible dynamic anchor points in a benzoxazinone derivative–human oxytocin receptor system — a molecular docking and dynamics calculation

Balázs Jójárt, Árpád Márki

Journal:

Journal of Molecular Modeling

Year:

2007

Language:

english

File:

PDF, 404 KB

english, 2007

19

Role of Aromacity, Ring Strain, and Stereochemistry of Selected Disulfides and Their Congeners in the Oxidative Linkage of DNA Strands at the Major Groove. A Computational Study †

Izsak, Robert, Jojart, Balazs, Csizmadia, Imre G., Viskolcz, Bela

Journal:

Journal of Chemical Information and Modeling

Year:

2006

Language:

english

File:

PDF, 601 KB

english, 2006

20

Hydrogen bonding networks inE- orZ-2-(3'-pyridyl)-3-phenylpropenoic (α-pyridylcinnamic) acid assemblies – a molecular modeling study

Balázs Jójárt, István Pálinkó

Journal:

Journal of Molecular Modeling

Year:

2001

Language:

english

File:

PDF, 333 KB

english, 2001

21

Conformation change of opiorphin derivates. A theoretical study of the radical initiated epimerization of opiorphin

Szórád, János J., Faragó, Eszter P., Rágyanszki, Anita, Cimino, Franco A., Fiser, Béla, Owen, Michael C., Jójárt, Balázs, Morgado, Claudio A., Szőri, Milán, Jensen, Svend J. Knak, Csizmadia, Imre G.,

Journal:

Chemical Physics Letters

Year:

2015

Language:

english

File:

PDF, 1.56 MB

english, 2015

22

AIP Conference Proceedings [AIP Publishing LLC TIM 2013 PHYSICS CONFERENCE - Timisoara, Romania (21–24 November 2013)] - Model based computation of the impurity distribution in the wall of a tube grown from the melt by the edge-defined film-fed growth technique

Balint, Agneta M., Balint, Stefan, Jójárt, Balázs

Year:

2014

Language:

english

File:

PDF, 342 KB

english, 2014

23

Performance of the general amber force field in modeling aqueous POPC membrane bilayers

Balázs Jójárt, Tamás A. Martinek

Journal:

Journal of Computational Chemistry

Year:

2007

Language:

english

File:

PDF, 260 KB

english, 2007

24

Receptor-based QSAR studies of non-peptide human oxytocin receptor antagonists

Balázs Jójárt, Árpád Márki

Journal:

Journal of Molecular Graphics and Modelling

Year:

2007

Language:

english

File:

PDF, 926 KB

english, 2007

25

The effect of a Pro28Thr point mutation on the local structure and stability of human galactokinase enzyme—a theoretical study

Balázs Jójárt, Milán Szőri, Róbert Izsák, István Marsi, Aranka László, Imre G. Csizmadia, Béla Viskolcz

Journal:

Journal of Molecular Modeling

Year:

2011

Language:

english

File:

PDF, 691 KB

english, 2011

26

Effect of general anesthetics on the properties of lipid membranes of various compositions

Hantal, György, Fábián, Balázs, Sega, Marcello, Jójárt, Balázs, Jedlovszky, Pál

Journal:

Biochimica et Biophysica Acta (BBA) - Biomembranes

Year:

2018

Language:

english

File:

PDF, 11.15 MB

english, 2018

27

Homology Modeling and Validation of the Human M1 Muscarinic Acetylcholine Receptor

Balázs Jójárt, Agneta M. Balint, Stefan Balint, Béla Viskolcz

Journal:

Molecular Informatics

Year:

2012

Language:

english

File:

PDF, 427 KB

english, 2012

28

The Impact of Molecular Dynamics Sampling on the Performance of Virtual Screening against GPCRs

Tarcsay, Ákos, Paragi, Gábor, Vass, Márton, Jójárt, Balázs, Bogár, Ferenc, Keserű, György M.

Journal:

Journal of Chemical Information and Modeling

Year:

2013

Language:

english

File:

PDF, 1.12 MB

english, 2013

29

Allosteric Activation of Metabotropic Glutamate Receptor 5

Jójárt, Balázs, Orgován, Zoltán, Márki, Árpád, Pándy-Szekeres, Gáspár, Ferenczy, György G., Keserű, György M.

Journal:

Journal of Biomolecular Structure and Dynamics

Year:

2019

Language:

english

File:

PDF, 1.02 MB

english, 2019

30

Identification of Novel Histamine H4 Ligands by Virtual Screening on Molecular Dynamics Ensembles

Kiss, Róbert, Jójárt, Balázs, Schmidt, Éva, Kiss, Béla, Keserű, György M.

Journal:

Molecular Informatics

Year:

2014

Language:

english

File:

PDF, 883 KB

english, 2014

31

Dynamics and structural determinants of ligand recognition of the 5-HT6 receptor

Vass, Márton, Jójárt, Balázs, Bogár, Ferenc, Paragi, Gábor, Keserű, György M., Tarcsay, Ákos

Journal:

Journal of Computer-Aided Molecular Design

Year:

2015

Language:

english

File:

PDF, 1.54 MB

english, 2015

32

A hidden active site in the potential drug target Mycobacterium tuberculosis dUTPase is accessible through small-amplitude protein conformational changes

Lopata, Anna, Leveles, Ibolya, Bendes, Abris A., Viskolcz, Bela, Vertessy, Beata G., Jojart, Balazs, Toth, Judit

Journal:

Journal of Biological Chemistry

Year:

2016

Language:

english

File:

PDF, 2.91 MB

english, 2016

33

Penicillin's catalytic mechanism revealed by inelastic neutrons and quantum chemical theory

Mucsi, Zoltán, Chass, Gregory A., Ábrányi-Balogh, Péter, Jójárt, Balázs, Fang, De-Cai, Ramirez-Cuesta, Annibal J., Viskolcz, Béla, Csizmadia, Imre G.

Journal:

Physical Chemistry Chemical Physics

Year:

2013

Language:

english

File:

PDF, 3.89 MB

english, 2013

34

Molecular ageing: Free radical initiated epimerization of thymopentin – A case study

Sheykhkarimli, Dayag, Choo, Ken-Loon, Owen, Michael, Fiser, Béla, Jójárt, Balázs, Csizmadia, Imre G., Viskolcz, Béla

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.40 MB

english, 2014

35

Chemical evolution of biomolecule building blocks. Can thermodynamics explain the accumulation of glycine in the prebiotic ocean?

Szőri, Milán, Jójárt, Balázs, Izsák, Róbert, Szőri, Kornél, Csizmadia, Imre G., Viskolcz, Béla

Journal:

Physical Chemistry Chemical Physics

Year:

2011

Language:

english

File:

PDF, 2.51 MB

english, 2011

36

Modeling the human oxytocin receptor for drug discovery efforts

Jójárt, Balázs, Balogh, Balázs, Márki, Árpád

Journal:

Expert Opinion on Drug Discovery

Year:

2007

Language:

english

File:

PDF, 1.36 MB

english, 2007

37

Formulation of paracetamol-containing pastilles with in situ coating technology

Katona, Gábor, Szalontai, Balázs, Budai-Szűcs, Mária, Csányi, Erzsébet, Szabó-Révész, Piroska, Jójárt-Laczkovich, Orsolya

Journal:

European Journal of Pharmaceutical Sciences

Year:

2016

Language:

english

File:

PDF, 1.62 MB

english, 2016

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