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Items: 1 to 50 of 93

1.

Solid Oganesson via a Many-Body Interaction Expansion Based on Relativistic Coupled-Cluster Theory and from Plane-Wave Relativistic Density Functional Theory.

Jerabek P, Smits OR, Mewes JM, Peterson KA, Schwerdtfeger P.

J Phys Chem A. 2019 May 16;123(19):4201-4211. doi: 10.1021/acs.jpca.9b01947. Epub 2019 May 6.

PMID:
31017443
2.

Ligands Based on Phosphine-Stabilized Aluminum(I), Boron(I), and Carbon(0).

Vondung L, Jerabek P, Langer R.

Chemistry. 2019 Feb 26;25(12):3068-3076. doi: 10.1002/chem.201805123. Epub 2019 Jan 29.

PMID:
30565756
3.

Dative and electron-sharing bonding in transition metal compounds.

Jerabek P, Schwerdtfeger P, Frenking G.

J Comput Chem. 2019 Jan 5;40(1):247-264. doi: 10.1002/jcc.25584. Epub 2018 Oct 26.

PMID:
30365176
4.

Ghrelin Receptor Antagonism of Methamphetamine-Induced Conditioned Place Preference and Intravenous Self-Administration in Rats.

Havlickova T, Charalambous C, Lapka M, Puskina N, Jerabek P, Sustkova-Fiserova M.

Int J Mol Sci. 2018 Sep 26;19(10). pii: E2925. doi: 10.3390/ijms19102925.

5.

Suppressed Phosphine Dissociation by Polarization Effects on the Donor-Acceptor Bonds in [Ni(PEt3)4- n(ECp*) n] (E = Al, Ga).

Hornung J, Weßing J, Jerabek P, Gemel C, Pöthig A, Frenking G, Fischer RA.

Inorg Chem. 2018 Oct 15;57(20):12657-12664. doi: 10.1021/acs.inorgchem.8b01817. Epub 2018 Sep 24.

PMID:
30247024
6.

Structure evolution of h.c.p./c.c.p. metal oxide interfaces in solid-state reactions.

Li C, Habler G, Griffiths T, Rečnik A, Jeřábek P, Götze LC, Mangler C, Pennycook TJ, Meyer J, Abart R.

Acta Crystallogr A Found Adv. 2018 Sep 1;74(Pt 5):466-480. doi: 10.1107/S205327331800757X. Epub 2018 Aug 8.

PMID:
30182934
7.

A Hundred-Year-Old Experiment Re-evaluated: Accurate Ab Initio Monte Carlo Simulations of the Melting of Radon.

Smits OR, Jerabek P, Pahl E, Schwerdtfeger P.

Angew Chem Int Ed Engl. 2018 Jul 26;57(31):9961-9964. doi: 10.1002/anie.201803353. Epub 2018 Jul 9.

PMID:
29896841
8.

Tipping the Balance between Ligand and Metal Protonation due to Relativistic Effects: Unusually High Proton Affinity in Gold(I) Pincer Complexes.

Jerabek P, Vondung L, Schwerdtfeger P.

Chemistry. 2018 Apr 20;24(23):6047-6051. doi: 10.1002/chem.201800755. Epub 2018 Mar 27.

PMID:
29498134
9.

Electron and Nucleon Localization Functions of Oganesson: Approaching the Thomas-Fermi Limit.

Jerabek P, Schuetrumpf B, Schwerdtfeger P, Nazarewicz W.

Phys Rev Lett. 2018 Feb 2;120(5):053001. doi: 10.1103/PhysRevLett.120.053001.

PMID:
29481184
10.

Alterations in Rat Accumbens Endocannabinoid and GABA Content during Fentanyl Treatment: The Role of Ghrelin.

Sustkova-Fiserova M, Charalambous C, Havlickova T, Lapka M, Jerabek P, Puskina N, Syslova K.

Int J Mol Sci. 2017 Nov 22;18(11). pii: E2486. doi: 10.3390/ijms18112486.

11.

Influence of Relativistic Effects on Bonding Modes in M(II) Dinuclear Complexes (M = Au, Ag, and Cu).

Jerabek P, von der Esch B, Schmidbaur H, Schwerdtfeger P.

Inorg Chem. 2017 Dec 4;56(23):14624-14631. doi: 10.1021/acs.inorgchem.7b02434. Epub 2017 Nov 14.

PMID:
29135228
12.

Radial artery neointimal hyperplasia after transradial PCI-Serial optical coherence tomography volumetric study.

Kala P, Kanovsky J, Novakova T, Miklik R, Bocek O, Poloczek M, Jerabek P, Prymkova L, Ondrus T, Jarkovsky J, Blaha M, Mintz GS.

PLoS One. 2017 Oct 10;12(10):e0185404. doi: 10.1371/journal.pone.0185404. eCollection 2017.

13.

Ghrelin receptor antagonism of morphine-induced conditioned place preference and behavioral and accumbens dopaminergic sensitization in rats.

Jerabek P, Havlickova T, Puskina N, Charalambous C, Lapka M, Kacer P, Sustkova-Fiserova M.

Neurochem Int. 2017 Nov;110:101-113. doi: 10.1016/j.neuint.2017.09.013. Epub 2017 Sep 27.

PMID:
28958601
14.

Characterization of Macrophage Polarization States Using Combined Measurement of 2-Deoxyglucose and Glutamine Accumulation: Implications for Imaging of Atherosclerosis.

Tavakoli S, Downs K, Short JD, Nguyen HN, Lai Y, Jerabek PA, Goins B, Toczek J, Sadeghi MM, Asmis R.

Arterioscler Thromb Vasc Biol. 2017 Oct;37(10):1840-1848. doi: 10.1161/ATVBAHA.117.308848. Epub 2017 Aug 10.

PMID:
28798141
15.

Zn···Zn interactions at nickel and palladium centers.

Freitag K, Molon M, Jerabek P, Dilchert K, Rösler C, Seidel RW, Gemel C, Frenking G, Fischer RA.

Chem Sci. 2016 Oct 1;7(10):6413-6421. doi: 10.1039/c6sc02106a. Epub 2016 Jun 23.

16.

Differential Regulation of Macrophage Glucose Metabolism by Macrophage Colony-stimulating Factor and Granulocyte-Macrophage Colony-stimulating Factor: Implications for 18F FDG PET Imaging of Vessel Wall Inflammation.

Tavakoli S, Short JD, Downs K, Nguyen HN, Lai Y, Zhang W, Jerabek P, Goins B, Sadeghi MM, Asmis R.

Radiology. 2017 Apr;283(1):87-97. doi: 10.1148/radiol.2016160839. Epub 2016 Nov 16.

17.

Lipid molecules can induce an opening of membrane-facing tunnels in cytochrome P450 1A2.

Jeřábek P, Florián J, Martínek V.

Phys Chem Chem Phys. 2016 Nov 9;18(44):30344-30356.

18.

Short sheath benefit in radial artery injury after PCI - optical coherence tomography serial study.

Novakova T, Kanovsky J, Miklik R, Bocek O, Poloczek M, Jerabek P, Privarova L, Ondrus T, Jarkovsky J, Benesova K, Spinar J, Kala P.

Biomed Pap Med Fac Univ Palacky Olomouc Czech Repub. 2016 Sep;160(3):393-8. doi: 10.5507/bp.2016.035. Epub 2016 Sep 13.

19.

The Oxygen-Rich Beryllium Oxides BeO4 and BeO6.

Zhang Q, Jerabek P, Chen M, Zhou M, Frenking G.

Angew Chem Int Ed Engl. 2016 Aug 26;55(36):10863-7. doi: 10.1002/anie.201606154. Epub 2016 Aug 5.

PMID:
27494950
20.

The value of novel invasive hemodynamic parameters added to the TIMI risk score for short-term prognosis assessment in patients with ST segment elevation myocardial infarction.

Tesak M, Kala P, Jarkovsky J, Poloczek M, Bocek O, Jerabek P, Kubková L, Manousek J, Spinar J, Mebazaa A, Parenica J, Cohen-Solal A.

Int J Cardiol. 2016 Jul 1;214:235-40. doi: 10.1016/j.ijcard.2016.03.073. Epub 2016 Mar 24.

PMID:
27077540
21.

Membrane-Anchored Cytochrome P450 1A2-Cytochrome b5 Complex Features an X-Shaped Contact between Antiparallel Transmembrane Helices.

Jeřábek P, Florián J, Martínek V.

Chem Res Toxicol. 2016 Apr 18;29(4):626-36. doi: 10.1021/acs.chemrestox.5b00349. Epub 2016 Mar 16.

PMID:
26918755
22.

Ferrous and ferric state of cytochromes P450 in intact Escherichia coli cells: a possible role of cytochrome P450-flavodoxin interactions.

Culka M, Milichovsky J, Jerabek P, Stiborova M, Martinek V.

Neuro Endocrinol Lett. 2015;36 Suppl 1:29-37.

PMID:
26757119
23.

Ghrelin and endocannabinoids participation in morphine-induced effects in the rat nucleus accumbens.

Sustkova-Fiserova M, Jerabek P, Havlickova T, Syslova K, Kacer P.

Psychopharmacology (Berl). 2016 Feb;233(3):469-84. doi: 10.1007/s00213-015-4119-3. Epub 2015 Oct 28.

PMID:
26507196
24.

Reward related neurotransmitter changes in a model of depression: An in vivo microdialysis study.

Ruda-Kucerova J, Amchova P, Havlickova T, Jerabek P, Babinska Z, Kacer P, Syslova K, Sulcova A, Sustkova-Fiserova M.

World J Biol Psychiatry. 2015 Oct;16(7):521-35. doi: 10.3109/15622975.2015.1077991. Epub 2015 Oct 7.

PMID:
26444572
25.

The σ-aromatic clusters [Zn₃]⁺ and [Zn₂Cu]: embryonic brass.

Freitag K, Gemel C, Jerabek P, Oppel IM, Seidel RW, Frenking G, Banh H, Dilchert K, Fischer RA.

Angew Chem Int Ed Engl. 2015 Mar 27;54(14):4370-4. doi: 10.1002/anie.201410737. Epub 2015 Feb 12.

PMID:
25676739
26.

Dizinc cation [Zn2](2+) trapped in a homoleptic metalloid coordination environment stabilized by dispersion forces: [Zn2(GaCp*)6][BAr4(F)]2.

Freitag K, Banh H, Gemel C, Jerabek P, Seidel RW, Frenking G, Fischer RA.

Inorg Chem. 2015 Jan 5;54(1):352-8. doi: 10.1021/ic502532g. Epub 2014 Dec 17.

PMID:
25517995
27.

Coinage metals binding as main group elements: structure and bonding of the carbene complexes [TM(cAAC)2] and [TM(cAAC)2](+) (TM = Cu, Ag, Au).

Jerabek P, Roesky HW, Bertrand G, Frenking G.

J Am Chem Soc. 2014 Dec 10;136(49):17123-35. doi: 10.1021/ja508887s. Epub 2014 Nov 25.

PMID:
25394669
28.

Flexible docking-based molecular dynamics/steered molecular dynamics calculations of protein-protein contacts in a complex of cytochrome P450 1A2 with cytochrome b5.

Jeřábek P, Florián J, Stiborová M, Martínek V.

Biochemistry. 2014 Oct 28;53(42):6695-705. doi: 10.1021/bi500814t. Epub 2014 Oct 14.

PMID:
25313797
29.

Hume-Rothery phase-inspired metal-rich molecules: cluster expansion of [Ni(ZnMe)₆(ZnCp*)₂] by face capping with Ni⁰(η⁶-toluene) and Ni(I)(η⁵-Cp*).

Molon M, Gemel C, Jerabek P, Trombach L, Frenking G, Fischer RA.

Inorg Chem. 2014 Oct 6;53(19):10403-11. doi: 10.1021/ic5014335. Epub 2014 Sep 22.

PMID:
25244516
30.

Bonding analysis of telluroketones H₂A = Te (A = C, Si, Ge).

Jaufeerally NB, Ramasami P, Jerabek P, Frenking G.

J Mol Model. 2014 Oct;20(10):2433. doi: 10.1007/s00894-014-2433-z. Epub 2014 Sep 21.

PMID:
25241160
31.

[Near-infrared spectroscopy (NIRS), new intracoronary imaging technique of unstable coronary plaque].

Ondrúš T, Kaňovský J, Poloczek M, Miklík R, Boček O, Jeřábek P, Kala P.

Vnitr Lek. 2014 May-Jun;60(5-6):531-4. Czech.

PMID:
24974760
32.

Isolation of neutral mononuclear copper complexes stabilized by two cyclic (alkyl)(amino)carbenes.

Weinberger DS, Amin Sk N, Mondal KC, Melaimi M, Bertrand G, Stückl AC, Roesky HW, Dittrich B, Demeshko S, Schwederski B, Kaim W, Jerabek P, Frenking G.

J Am Chem Soc. 2014 Apr 30;136(17):6235-8. doi: 10.1021/ja502521b. Epub 2014 Apr 17.

PMID:
24731250
33.

A novel concept for the synthesis of multiply doped gold clusters [(M@Au(n)M'(m))L(k)](q+).

Puls A, Jerabek P, Kurashige W, Förster M, Molon M, Bollermann T, Winter M, Gemel C, Negishi Y, Frenking G, Fischer RA.

Angew Chem Int Ed Engl. 2014 Apr 22;53(17):4327-31. doi: 10.1002/anie.201310436. Epub 2014 Apr 2.

PMID:
24700545
34.

Ghrelin receptor antagonism of morphine-induced accumbens dopamine release and behavioral stimulation in rats.

Sustkova-Fiserova M, Jerabek P, Havlickova T, Kacer P, Krsiak M.

Psychopharmacology (Berl). 2014 Jul;231(14):2899-908. doi: 10.1007/s00213-014-3466-9. Epub 2014 Feb 15.

PMID:
24531567
35.

Experimental charge density study of a silylone.

Niepötter B, Herbst-Irmer R, Kratzert D, Samuel PP, Mondal KC, Roesky HW, Jerabek P, Frenking G, Stalke D.

Angew Chem Int Ed Engl. 2014 Mar 3;53(10):2766-70. doi: 10.1002/anie.201308609. Epub 2014 Jan 30.

PMID:
24481811
36.

Nearly degenerate isomers of C(BH)2: cumulene, carbene, or carbone?

Barua SR, Allen WD, Kraka E, Jerabek P, Sure R, Frenking G.

Chemistry. 2013 Nov 18;19(47):15941-54. doi: 10.1002/chem.201302181. Epub 2013 Oct 7.

PMID:
24123325
37.

[3+2] Fragmentation of an [RP(5)Cl](+) cage cation induced by an N-heterocyclic carbene.

Holthausen MH, Surmiak SK, Jerabek P, Frenking G, Weigand JJ.

Angew Chem Int Ed Engl. 2013 Oct 11;52(42):11078-82. doi: 10.1002/anie.201302914. Epub 2013 Aug 22.

PMID:
24038818
38.

Isolation of neutral mono- and dinuclear gold complexes of cyclic (alkyl)(amino)carbenes.

Weinberger DS, Melaimi M, Moore CE, Rheingold AL, Frenking G, Jerabek P, Bertrand G.

Angew Chem Int Ed Engl. 2013 Aug 19;52(34):8964-7. doi: 10.1002/anie.201304820. Epub 2013 Jul 16. No abstract available.

PMID:
23861304
39.

The organozinc rich compounds [Cp*M(ZnR)5] (M = Fe, Ru; R = Cp*, Me, Cl, Br).

Molon M, Gemel C, Seidel RW, Jerabek P, Frenking G, Fischer RA.

Inorg Chem. 2013 Jun 17;52(12):7152-60. doi: 10.1021/ic400741b. Epub 2013 May 23.

PMID:
23701675
40.

SQUID magnetometry combined with in situ cyclic voltammetry: A case study of tunable magnetism of [Formula: see text]-Fe2O3 nanoparticles.

Topolovec S, Jerabek P, Szabó DV, Krenn H, Würschum R.

J Magn Magn Mater. 2013 Mar;329(2-2):43-48.

41.

Reductive elimination: a pathway to low-valent aluminium species.

Ganesamoorthy C, Loerke S, Gemel C, Jerabek P, Winter M, Frenking G, Fischer RA.

Chem Commun (Camb). 2013 Apr 11;49(28):2858-60. doi: 10.1039/c3cc38584a.

PMID:
23381663
42.

Theoretical investigation of differences in nitroreduction of aristolochic acid I by cytochromes P450 1A1, 1A2 and 1B1.

Jerabek P, Martinek V, Stiborova M.

Neuro Endocrinol Lett. 2012;33 Suppl 3:25-32.

PMID:
23353840
43.

Catalytic effects of mutations of distant protein residues in human DNA polymerase β: theory and experiment.

Klvaňa M, Murphy DL, Jeřábek P, Goodman MF, Warshel A, Sweasy JB, Florián J.

Biochemistry. 2012 Nov 6;51(44):8829-43. doi: 10.1021/bi300783t. Epub 2012 Oct 29.

44.

A crystalline singlet phosphinonitrene: a nitrogen atom-transfer agent.

Dielmann F, Back O, Henry-Ellinger M, Jerabek P, Frenking G, Bertrand G.

Science. 2012 Sep 21;337(6101):1526-8.

45.

Oligonuclear molecular models of intermetallic phases: a case study on [Pd2Zn6Ga2(Cp*)5(CH3)3].

Bollermann T, Molon M, Gemel C, Freitag K, Seidel RW, von Hopffgarten M, Jerabek P, Frenking G, Fischer RA.

Chemistry. 2012 Apr 16;18(16):4909-15. doi: 10.1002/chem.201102758. Epub 2012 Mar 13.

PMID:
22416016
46.

Ligand-stabilized [P4]2+ cations.

Donath M, Conrad E, Jerabek P, Frenking G, Fröhlich R, Burford N, Weigand JJ.

Angew Chem Int Ed Engl. 2012 Mar 19;51(12):2964-7. doi: 10.1002/anie.201109010. Epub 2012 Feb 6. No abstract available.

PMID:
22311780
47.

The rich chemistry of [Zn2Cp*2]: trapping three different types of zinc ligands in the PdZn7 complex [Pd(ZnCp*)4(ZnMe)2{Zn(tmeda)}].

Bollermann T, Freitag K, Gemel C, Molon M, Seidel RW, von Hopffgarten M, Jerabek P, Frenking G, Fischer RA.

Inorg Chem. 2011 Oct 17;50(20):10486-92. doi: 10.1021/ic201701r. Epub 2011 Sep 19.

PMID:
21928774
48.

An abridged transition state model to derive structure, dynamics, and energy components of DNA polymerase β fidelity.

Klvaňa M, Jeřábek P, Goodman MF, Florián J.

Biochemistry. 2011 Aug 16;50(32):7023-32. doi: 10.1021/bi200790s. Epub 2011 Jul 25.

49.

Relationship between high aortic pulse pressure and extension of coronary atherosclerosis in males.

Pařenica J, Kala P, Jarkovský J, Poloczek M, Boček O, Jeřábek P, Neugebauer P, Vytiska M, Pařenicová I, Tomčíková D, Pávková Goldbergová M, Spinar J.

Physiol Res. 2011;60(1):47-53. Epub 2010 Oct 15.

50.

Pharmacological modulation of the micturition pattern in normal and cyclophosphamide pre-treated conscious rats.

Andersson M, Aronsson P, Giglio D, Wilhelmson A, Jeřábek P, Tobin G.

Auton Neurosci. 2011 Jan 20;159(1-2):77-83. doi: 10.1016/j.autneu.2010.08.008. Epub 2010 Sep 18.

PMID:
20851691

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