Jojart B - Search Results

1

Rationally designed foldameric adjuvants enhance antibiotic efficacy via promoting membrane hyperpolarization.

Bhaumik KN, Hetényi A, Olajos G, Martins A, Spohn R, Németh L, Jojart B, Szili P, Dunai A, Jangir PK, Daruka L, Földesi I, Kata D, Pál C, Martinek TA. Bhaumik KN, et al. Among authors: jojart b. Mol Syst Des Eng. 2021 Nov 11;7(1):21-33. doi: 10.1039/d1me00118c. eCollection 2022 Jan 4. Mol Syst Des Eng. 2021. PMID: 35127141 Free PMC article.

2

Tilted State Population of Antimicrobial Peptide PGLa Is Coupled to the Transmembrane Potential.

Németh LJ, Martinek TA, Jójárt B. Németh LJ, et al. Among authors: jojart b. J Chem Inf Model. 2022 Oct 24;62(20):4963-4969. doi: 10.1021/acs.jcim.2c00667. Epub 2022 Oct 3. J Chem Inf Model. 2022. PMID: 36190907 Free PMC article.

3

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.

Jójárt B, Martinek TA, Márki A. Jójárt B, et al. J Comput Aided Mol Des. 2005 May;19(5):341-56. doi: 10.1007/s10822-005-7137-0. J Comput Aided Mol Des. 2005. PMID: 16184436

4

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

Jójárt B, Martinek TA. Jójárt B, et al. J Comput Chem. 2007 Sep;28(12):2051-8. doi: 10.1002/jcc.20748. J Comput Chem. 2007. PMID: 17431937

5

Molecular Dynamics and Metadynamics Insights of 1,4-Dioxane-Induced Structural Changes of Biomembrane Models.

Rózsa ZB, Németh LJ, Jójárt B, Nehéz K, Viskolcz B, Szőri M. Rózsa ZB, et al. Among authors: jojart b. J Phys Chem B. 2019 Sep 19;123(37):7869-7884. doi: 10.1021/acs.jpcb.9b04313. Epub 2019 Sep 10. J Phys Chem B. 2019. PMID: 31452375

6

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

Vass M, Jójárt B, Bogár F, Paragi G, Keserű GM, Tarcsay Á. Vass M, et al. Among authors: jojart b. J Comput Aided Mol Des. 2015 Dec;29(12):1137-49. doi: 10.1007/s10822-015-9883-y. Epub 2015 Nov 16. J Comput Aided Mol Des. 2015. PMID: 26572911

7

Comparative study of eight oxytocin antagonists by simulated annealing.

Jójárt B, Márki A. Jójárt B, et al. J Mol Model. 2006 Sep;12(6):823-8. doi: 10.1007/s00894-006-0104-4. Epub 2006 Mar 7. J Mol Model. 2006. PMID: 16520990

8

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

Jójárt B, Márki A. Jójárt B, et al. J Mol Model. 2007 Jan;13(1):1-10. doi: 10.1007/s00894-006-0112-4. Epub 2006 May 5. J Mol Model. 2007. PMID: 16676211

9

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

Jójárt B, Márki A. Jójárt B, et al. J Mol Graph Model. 2007 Jan;25(5):711-20. doi: 10.1016/j.jmgm.2006.05.010. Epub 2006 Jun 7. J Mol Graph Model. 2007. PMID: 16857401

10

3D QSAR models for alpha2a-adrenoceptor agonists.

Balogh B, Jójárt B, Wágner Z, Kovács P, Máté G, Gyires K, Zádori Z, Falkay G, Márki A, Viskolcz B, Mátyus P. Balogh B, et al. Among authors: jojart b. Neurochem Int. 2007 Oct;51(5):268-76. doi: 10.1016/j.neuint.2007.05.021. Epub 2007 Jun 14. Neurochem Int. 2007. PMID: 17643557

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