Fanfrlík J - Search Results

1

Unraveling the anti-influenza effect of flavonoids: Experimental validation of luteolin and its congeners as potent influenza endonuclease inhibitors.

Zima V, Radilová K, Kožíšek M, Albiñana CB, Karlukova E, Brynda J, Fanfrlík J, Flieger M, Hodek J, Weber J, Majer P, Konvalinka J, Machara A. Zima V, et al. Among authors: fanfrlik j. Eur J Med Chem. 2020 Dec 15;208:112754. doi: 10.1016/j.ejmech.2020.112754. Epub 2020 Aug 22. Eur J Med Chem. 2020. PMID: 32883638 Free article.

2

The Telluraboranes closo-TeB₅ Cl₅ and closo-TeB₁₁ Cl₁₁ with Exceptionally Long Body Diagonals: Synthetic and Bonding Motifs for Innovative Octahedral and Icosahedral Geometries.

Keller W, Ballmann J, Sárosi MB, Fanfrlík J, Hnyk D. Keller W, et al. Among authors: fanfrlik j. Angew Chem Int Ed Engl. 2023 Jun 12;62(24):e202219018. doi: 10.1002/anie.202219018. Epub 2023 May 4. Angew Chem Int Ed Engl. 2023. PMID: 36912896

3

Inorganic polyhedral metallacarborane inhibitors of HIV protease: a new approach to overcoming antiviral resistance.

Kozísek M, Cígler P, Lepsík M, Fanfrlík J, Rezácová P, Brynda J, Pokorná J, Plesek J, Grüner B, Grantz Sasková K, Václavíková J, Král V, Konvalinka J. Kozísek M, et al. Among authors: fanfrlik j. J Med Chem. 2008 Aug 14;51(15):4839-43. doi: 10.1021/jm8002334. Epub 2008 Jul 4. J Med Chem. 2008. PMID: 18598016

4

Interpretation of protein/ligand crystal structure using QM/MM calculations: case of HIV-1 protease/metallacarborane complex.

Fanfrlík J, Brynda J, Rezác J, Hobza P, Lepsík M. Fanfrlík J, et al. J Phys Chem B. 2008 Nov 27;112(47):15094-102. doi: 10.1021/jp803528w. J Phys Chem B. 2008. PMID: 18975888

5

Design of HIV protease inhibitors based on inorganic polyhedral metallacarboranes.

Rezácová P, Pokorná J, Brynda J, Kozísek M, Cígler P, Lepsík M, Fanfrlík J, Rezác J, Grantz Sasková K, Sieglová I, Plesek J, Sícha V, Grüner B, Oberwinkler H, Sedlácek' J, Kräusslich HG, Hobza P, Král V, Konvalinka J. Rezácová P, et al. Among authors: fanfrlik j. J Med Chem. 2009 Nov 26;52(22):7132-41. doi: 10.1021/jm9011388. J Med Chem. 2009. PMID: 19874035

6

A reliable docking/scoring scheme based on the semiempirical quantum mechanical PM6-DH2 method accurately covering dispersion and H-bonding: HIV-1 protease with 22 ligands.

Fanfrlík J, Bronowska AK, Rezác J, Prenosil O, Konvalinka J, Hobza P. Fanfrlík J, et al. J Phys Chem B. 2010 Oct 7;114(39):12666-78. doi: 10.1021/jp1032965. J Phys Chem B. 2010. PMID: 20839830

7

Structural basis for inhibition of cathepsin B drug target from the human blood fluke, Schistosoma mansoni.

Jílková A, Řezáčová P, Lepšík M, Horn M, Váchová J, Fanfrlík J, Brynda J, McKerrow JH, Caffrey CR, Mareš M. Jílková A, et al. Among authors: fanfrlik j. J Biol Chem. 2011 Oct 14;286(41):35770-35781. doi: 10.1074/jbc.M111.271304. Epub 2011 Aug 10. J Biol Chem. 2011. PMID: 21832058 Free PMC article.

8

Quantum mechanics-based scoring rationalizes the irreversible inactivation of parasitic Schistosoma mansoni cysteine peptidase by vinyl sulfone inhibitors.

Fanfrlík J, Brahmkshatriya PS, Řezáč J, Jílková A, Horn M, Mareš M, Hobza P, Lepšík M. Fanfrlík J, et al. J Phys Chem B. 2013 Dec 5;117(48):14973-82. doi: 10.1021/jp409604n. Epub 2013 Nov 21. J Phys Chem B. 2013. PMID: 24195769

9

QM/MM calculations reveal the different nature of the interaction of two carborane-based sulfamide inhibitors of human carbonic anhydrase II.

Pecina A, Lepšík M, Řezáč J, Brynda J, Mader P, Řezáčová P, Hobza P, Fanfrlík J. Pecina A, et al. Among authors: fanfrlik j. J Phys Chem B. 2013 Dec 19;117(50):16096-104. doi: 10.1021/jp410216m. Epub 2013 Dec 11. J Phys Chem B. 2013. PMID: 24289143

10

Structural basis for inhibition of mycobacterial and human adenosine kinase by 7-substituted 7-(Het)aryl-7-deazaadenine ribonucleosides.

Snášel J, Nauš P, Dostál J, Hnízda A, Fanfrlík J, Brynda J, Bourderioux A, Dušek M, Dvořáková H, Stolaříková J, Zábranská H, Pohl R, Konečný P, Džubák P, Votruba I, Hajdúch M, Rezáčová P, Veverka V, Hocek M, Pichová I. Snášel J, et al. Among authors: fanfrlik j. J Med Chem. 2014 Oct 23;57(20):8268-79. doi: 10.1021/jm500497v. Epub 2014 Oct 8. J Med Chem. 2014. PMID: 25259627

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