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Items: 1 to 50 of 82

1.

Erratum: "On the performance of DFT/MRCI Hamiltonians for electronic excitations in transition metal complexes: The role of the damping function" [J. Chem. Phys. 149, 164106 (2018)].

Heil A, Kleinschmidt M, Marian CM.

J Chem Phys. 2019 Jun 7;150(21):219903. doi: 10.1063/1.5109649. No abstract available.

PMID:
31176315
2.

Impact of fluorination on the photophysics of the flavin chromophore: a quantum chemical perspective.

Bracker M, Dinkelbach F, Weingart O, Kleinschmidt M.

Phys Chem Chem Phys. 2019 May 15;21(19):9912-9923. doi: 10.1039/c9cp00805e.

PMID:
31038527
3.

Meso scale discovery-based assays for the detection of aggregated huntingtin.

Reindl W, Baldo B, Schulz J, Janack I, Lindner I, Kleinschmidt M, Sedaghat Y, Thiede C, Tillack K, Schmidt C, Cardaun I, Schwagarus T, Herrmann F, Hotze M, Osborne GF, Herrmann S, Weiss A, Zerbinatti C, Bates GP, Bard J, Munoz-Sanjuan I, Macdonald D.

PLoS One. 2019 Mar 26;14(3):e0213521. doi: 10.1371/journal.pone.0213521. eCollection 2019.

4.

On the performance of DFT/MRCI Hamiltonians for electronic excitations in transition metal complexes: The role of the damping function.

Heil A, Kleinschmidt M, Marian CM.

J Chem Phys. 2018 Oct 28;149(16):164106. doi: 10.1063/1.5050476. Erratum in: J Chem Phys. 2019 Jun 7;150(21):219903.

PMID:
30384728
5.

Plant-made Salmonella bacteriocins salmocins for control of Salmonella pathovars.

Schneider T, Hahn-Löbmann S, Stephan A, Schulz S, Giritch A, Naumann M, Kleinschmidt M, Tusé D, Gleba Y.

Sci Rep. 2018 Mar 6;8(1):4078. doi: 10.1038/s41598-018-22465-9.

6.

Structural and functional analyses of pyroglutamate-amyloid-β-specific antibodies as a basis for Alzheimer immunotherapy.

Piechotta A, Parthier C, Kleinschmidt M, Gnoth K, Pillot T, Lues I, Demuth HU, Schilling S, Rahfeld JU, Stubbs MT.

J Biol Chem. 2017 Jul 28;292(30):12713-12724. doi: 10.1074/jbc.M117.777839. Epub 2017 Jun 16.

7.

Glutaminyl Cyclase Inhibitor PQ912 Improves Cognition in Mouse Models of Alzheimer's Disease-Studies on Relation to Effective Target Occupancy.

Hoffmann T, Meyer A, Heiser U, Kurat S, Böhme L, Kleinschmidt M, Bühring KU, Hutter-Paier B, Farcher M, Demuth HU, Lues I, Schilling S.

J Pharmacol Exp Ther. 2017 Jul;362(1):119-130. doi: 10.1124/jpet.117.240614. Epub 2017 Apr 26.

PMID:
28446518
8.

Assessment of Interstate Spin-Orbit Couplings from Linear Response Amplitudes.

Dinkelbach F, Kleinschmidt M, Marian CM.

J Chem Theory Comput. 2017 Feb 14;13(2):749-766. doi: 10.1021/acs.jctc.6b01122. Epub 2017 Jan 18.

PMID:
28045526
9.

Failure of the IDA in FRET Systems at Close Inter-Dye Distances Is Moderated by Frequent Low κ(2) Values.

Spiegel JD, Fulle S, Kleinschmidt M, Gohlke H, Marian CM.

J Phys Chem B. 2016 Sep 1;120(34):8845-62. doi: 10.1021/acs.jpcb.6b05754. Epub 2016 Aug 19.

PMID:
27490865
10.

Phosphorescence or Thermally Activated Delayed Fluorescence? Intersystem Crossing and Radiative Rate Constants of a Three-Coordinate Copper(I) Complex Determined by Quantum-Chemical Methods.

Föller J, Kleinschmidt M, Marian CM.

Inorg Chem. 2016 Aug 1;55(15):7508-16. doi: 10.1021/acs.inorgchem.6b00818. Epub 2016 Jul 18.

PMID:
27428010
11.

Temporary liver and stomach necrosis after lateral approach for interbody fusion and deformity correction of lumbar spine: report of two cases and review of the literature.

Vasiliadis HS, Teuscher R, Kleinschmidt M, Marrè S, Heini P.

Eur Spine J. 2016 May;25 Suppl 1:257-66. doi: 10.1007/s00586-016-4562-9. Epub 2016 Apr 6. Review.

PMID:
27052404
12.

Redesign of the DFT/MRCI Hamiltonian.

Lyskov I, Kleinschmidt M, Marian CM.

J Chem Phys. 2016 Jan 21;144(3):034104. doi: 10.1063/1.4940036.

PMID:
26801017
13.

Characterizing Aging, Mild Cognitive Impairment, and Dementia with Blood-Based Biomarkers and Neuropsychology.

Kleinschmidt M, Schoenfeld R, Göttlich C, Bittner D, Metzner JE, Leplow B, Demuth HU.

J Alzheimers Dis. 2016;50(1):111-26. doi: 10.3233/JAD-143189.

PMID:
26639953
14.

Quantum-Chemical Studies on Excitation Energy Transfer Processes in BODIPY-Based Donor-Acceptor Systems.

Spiegel JD, Kleinschmidt M, Larbig A, Tatchen J, Marian CM.

J Chem Theory Comput. 2015 Sep 8;11(9):4316-27. doi: 10.1021/acs.jctc.5b00501. Epub 2015 Aug 10.

PMID:
26575926
15.

An anti-pyroglutamate-3 Aβ vaccine reduces plaques and improves cognition in APPswe/PS1ΔE9 mice.

Frost JL, Liu B, Rahfeld JU, Kleinschmidt M, O'Nuallain B, Le KX, Lues I, Caldarone BJ, Schilling S, Demuth HU, Lemere CA.

Neurobiol Aging. 2015 Dec;36(12):3187-3199. doi: 10.1016/j.neurobiolaging.2015.08.021. Epub 2015 Aug 31.

16.

Intersystem-crossing and phosphorescence rates in fac-Ir(III)(ppy)3: a theoretical study involving multi-reference configuration interaction wavefunctions.

Kleinschmidt M, van Wüllen C, Marian CM.

J Chem Phys. 2015 Mar 7;142(9):094301. doi: 10.1063/1.4913513.

PMID:
25747075
17.

Isoglutaminyl cyclase contributes to CCL2-driven neuroinflammation in Alzheimer's disease.

Hartlage-Rübsamen M, Waniek A, Meissner J, Morawski M, Schilling S, Jäger C, Kleinschmidt M, Cynis H, Kehlen A, Arendt T, Demuth HU, Rossner S.

Acta Neuropathol. 2015 Apr;129(4):565-83. doi: 10.1007/s00401-015-1395-2. Epub 2015 Feb 11.

18.

Ubiquitous expression of the Pik3caH1047R mutation promotes hypoglycemia, hypoinsulinemia, and organomegaly.

Kinross KM, Montgomery KG, Mangiafico SP, Hare LM, Kleinschmidt M, Bywater MJ, Poulton IJ, Vrahnas C, Henneicke H, Malaterre J, Waring PM, Cullinane C, Sims NA, McArthur GA, Andrikopoulos S, Phillips WA.

FASEB J. 2015 Apr;29(4):1426-34. doi: 10.1096/fj.14-262782. Epub 2014 Dec 30.

PMID:
25550458
19.

A non-canonical function of eukaryotic elongation factor 1A1: regulation of interleukin-6 expression.

Schulz I, Engel C, Niestroj AJ, Kehlen A, Rahfeld JU, Kleinschmidt M, Lehmann K, Roßner S, Demuth HU.

Biochim Biophys Acta. 2014 May;1843(5):965-75. doi: 10.1016/j.bbamcr.2014.01.022. Epub 2014 Jan 31.

20.

Response of BRAF-mutant melanoma to BRAF inhibition is mediated by a network of transcriptional regulators of glycolysis.

Parmenter TJ, Kleinschmidt M, Kinross KM, Bond ST, Li J, Kaadige MR, Rao A, Sheppard KE, Hugo W, Pupo GM, Pearson RB, McGee SL, Long GV, Scolyer RA, Rizos H, Lo RS, Cullinane C, Ayer DE, Ribas A, Johnstone RW, Hicks RJ, McArthur GA.

Cancer Discov. 2014 Apr;4(4):423-33. doi: 10.1158/2159-8290.CD-13-0440. Epub 2014 Jan 27.

21.

Synergistic inhibition of ovarian cancer cell growth by combining selective PI3K/mTOR and RAS/ERK pathway inhibitors.

Sheppard KE, Cullinane C, Hannan KM, Wall M, Chan J, Barber F, Foo J, Cameron D, Neilsen A, Ng P, Ellul J, Kleinschmidt M, Kinross KM, Bowtell DD, Christensen JG, Hicks RJ, Johnstone RW, McArthur GA, Hannan RD, Phillips WA, Pearson RB.

Eur J Cancer. 2013 Dec;49(18):3936-44. doi: 10.1016/j.ejca.2013.08.007. Epub 2013 Sep 3.

PMID:
24011934
22.

Pyroglutamate-3 amyloid-β deposition in the brains of humans, non-human primates, canines, and Alzheimer disease-like transgenic mouse models.

Frost JL, Le KX, Cynis H, Ekpo E, Kleinschmidt M, Palmour RM, Ervin FR, Snigdha S, Cotman CW, Saido TC, Vassar RJ, St George-Hyslop P, Ikezu T, Schilling S, Demuth HU, Lemere CA.

Am J Pathol. 2013 Aug;183(2):369-81. doi: 10.1016/j.ajpath.2013.05.005. Epub 2013 Jun 7.

23.

Structural analysis of the pyroglutamate-modified isoform of the Alzheimer's disease-related amyloid-β using NMR spectroscopy.

Sun N, Hartmann R, Lecher J, Stoldt M, Funke SA, Gremer L, Ludwig HH, Demuth HU, Kleinschmidt M, Willbold D.

J Pept Sci. 2012 Nov;18(11):691-5. doi: 10.1002/psc.2456. Epub 2012 Sep 24.

PMID:
23001756
24.

[Translational research and diagnostics of melanoma].

Rüschoff J, Kleinschmidt M, Middel P.

Pathologe. 2012 Nov;33 Suppl 2:291-5. doi: 10.1007/s00292-012-1661-1. Review. German.

PMID:
22968732
25.

Cell cycle regulation by the PRMT6 arginine methyltransferase through repression of cyclin-dependent kinase inhibitors.

Kleinschmidt MA, de Graaf P, van Teeffelen HA, Timmers HT.

PLoS One. 2012;7(8):e41446. doi: 10.1371/journal.pone.0041446. Epub 2012 Aug 20.

26.

Passive immunization against pyroglutamate-3 amyloid-β reduces plaque burden in Alzheimer-like transgenic mice: a pilot study.

Frost JL, Liu B, Kleinschmidt M, Schilling S, Demuth HU, Lemere CA.

Neurodegener Dis. 2012;10(1-4):265-70. doi: 10.1159/000335913. Epub 2012 Feb 16.

27.

An activating Pik3ca mutation coupled with Pten loss is sufficient to initiate ovarian tumorigenesis in mice.

Kinross KM, Montgomery KG, Kleinschmidt M, Waring P, Ivetac I, Tikoo A, Saad M, Hare L, Roh V, Mantamadiotis T, Sheppard KE, Ryland GL, Campbell IG, Gorringe KL, Christensen JG, Cullinane C, Hicks RJ, Pearson RB, Johnstone RW, McArthur GA, Phillips WA.

J Clin Invest. 2012 Feb;122(2):553-7. doi: 10.1172/JCI59309. Epub 2012 Jan 3.

28.

The isoenzyme of glutaminyl cyclase is an important regulator of monocyte infiltration under inflammatory conditions.

Cynis H, Hoffmann T, Friedrich D, Kehlen A, Gans K, Kleinschmidt M, Rahfeld JU, Wolf R, Wermann M, Stephan A, Haegele M, Sedlmeier R, Graubner S, Jagla W, Müller A, Eichentopf R, Heiser U, Seifert F, Quax PH, de Vries MR, Hesse I, Trautwein D, Wollert U, Berg S, Freyse EJ, Schilling S, Demuth HU.

EMBO Mol Med. 2011 Sep;3(9):545-58. doi: 10.1002/emmm.201100158. Epub 2011 Jul 20.

29.

In vivo activity of combined PI3K/mTOR and MEK inhibition in a Kras(G12D);Pten deletion mouse model of ovarian cancer.

Kinross KM, Brown DV, Kleinschmidt M, Jackson S, Christensen J, Cullinane C, Hicks RJ, Johnstone RW, McArthur GA.

Mol Cancer Ther. 2011 Aug;10(8):1440-9. doi: 10.1158/1535-7163.MCT-11-0240. Epub 2011 Jun 1.

30.

On the photophysics of 1,6-diphenyl-1,3,5-hexatriene isomers and rotamers.

Küpper B, Kleinschmidt M, Schaper K, Marian CM.

Chemphyschem. 2011 Jul 11;12(10):1872-9. doi: 10.1002/cphc.201001068. Epub 2011 Apr 6.

PMID:
21472840
31.

MMP13 mediates cell cycle progression in melanocytes and melanoma cells: in vitro studies of migration and proliferation.

Meierjohann S, Hufnagel A, Wende E, Kleinschmidt MA, Wolf K, Friedl P, Gaubatz S, Schartl M.

Mol Cancer. 2010 Jul 28;9:201. doi: 10.1186/1476-4598-9-201.

32.

Thioxanthone: on the shape of the first absorption band.

Rai-Constapel V, Kleinschmidt M, Salzmann S, Serrano-Andrés L, Marian CM.

Phys Chem Chem Phys. 2010 Aug 28;12(32):9320-7. doi: 10.1039/b925059j. Epub 2010 Jul 7.

PMID:
20607180
33.

c-kit (CD117) expression in human tumors and its prognostic value: an immunohistochemical analysis.

Medinger M, Kleinschmidt M, Mross K, Wehmeyer B, Unger C, Schaefer HE, Weber R, Azemar M.

Pathol Oncol Res. 2010 Sep;16(3):295-301. doi: 10.1007/s12253-010-9247-9. Epub 2010 Feb 23.

PMID:
20177846
34.

[Inflammatory pseudotumour of the lung as a rare differential diagnosis of a pulmonary mass - a case report and overview of the literature].

Kleinschmidt MC, Scherbaum CW, Müller T.

Pneumologie. 2010 Apr;64(4):246-8. doi: 10.1055/s-0029-1215289. Epub 2009 Nov 18. Review. German.

35.

Increased chemoresistance induced by inhibition of HIF-prolyl-hydroxylase domain enzymes.

Brökers N, Le-Huu S, Vogel S, Hagos Y, Katschinski DM, Kleinschmidt M.

Cancer Sci. 2010 Jan;101(1):129-36. doi: 10.1111/j.1349-7006.2009.01367.x. Epub 2009 Sep 14.

36.

Electronic coherence provides a direct proof for energy-level crossing in photoexcited lutein and beta-carotene.

Ostroumov E, Müller MG, Marian CM, Kleinschmidt M, Holzwarth AR.

Phys Rev Lett. 2009 Sep 4;103(10):108302. Epub 2009 Sep 3.

PMID:
19792347
37.

Anti-cancer effects of artesunate in a panel of chemoresistant neuroblastoma cell lines.

Michaelis M, Kleinschmidt MC, Barth S, Rothweiler F, Geiler J, Breitling R, Mayer B, Deubzer H, Witt O, Kreuter J, Doerr HW, Cinatl J, Cinatl J Jr.

Biochem Pharmacol. 2010 Jan 15;79(2):130-6. doi: 10.1016/j.bcp.2009.08.013. Epub 2009 Aug 19.

PMID:
19698702
38.

Pyroglutamate formation influences solubility and amyloidogenicity of amyloid peptides.

Schlenzig D, Manhart S, Cinar Y, Kleinschmidt M, Hause G, Willbold D, Funke SA, Schilling S, Demuth HU.

Biochemistry. 2009 Jul 28;48(29):7072-8. doi: 10.1021/bi900818a.

PMID:
19518051
39.

Calculating electron paramagnetic resonance g-matrices for triplet state molecules from multireference spin-orbit configuration interaction wave functions.

Tatchen J, Kleinschmidt M, Marian CM.

J Chem Phys. 2009 Apr 21;130(15):154106. doi: 10.1063/1.3115965.

PMID:
19388735
40.

lin9 is required for mitosis and cell survival during early zebrafish development.

Kleinschmidt MA, Wagner TU, Liedtke D, Spahr S, Samans B, Gaubatz S.

J Biol Chem. 2009 May 8;284(19):13119-27. doi: 10.1074/jbc.M809635200. Epub 2009 Mar 11.

41.

Parallel multireference configuration interaction calculations on mini-beta-carotenes and beta-carotene.

Kleinschmidt M, Marian CM, Waletzke M, Grimme S.

J Chem Phys. 2009 Jan 28;130(4):044708. doi: 10.1063/1.3062842.

PMID:
19191405
42.

Clinical presentation of a traumatic cervical spine disc rupture in alpine sports: a case report.

Ecker TM, Kleinschmidt M, Martinolli L, Zimmermann H, Exadaktylos AK.

Scand J Trauma Resusc Emerg Med. 2008 Nov 12;16:14. doi: 10.1186/1757-7241-16-14.

43.

Transgenic overexpression of insulin receptor substrate 1 in hepatocytes enhances hepatocellular proliferation in young mice only.

Mohr L, Banerjee K, Kleinschmidt M, Bartolomé Rodríguez MM, Wands JR.

Hepatol Res. 2008 Dec;38(12):1233-40. doi: 10.1111/j.1872-034X.2008.00396.x. Epub 2008 Jul 4.

44.

The protein arginine methyltransferases CARM1 and PRMT1 cooperate in gene regulation.

Kleinschmidt MA, Streubel G, Samans B, Krause M, Bauer UM.

Nucleic Acids Res. 2008 Jun;36(10):3202-13. doi: 10.1093/nar/gkn166. Epub 2008 Apr 15.

45.

Transgenic mice replicating hepatitis B virus but lacking expression of the major HBsAg.

Halverscheid L, Mannes NK, Weth R, Kleinschmidt M, Schultz U, Reifenberg K, Schirmbeck R, Nassal M, Blum HE, Reimann J, Geissler M.

J Med Virol. 2008 Apr;80(4):583-90. doi: 10.1002/jmv.21115.

PMID:
18297704
46.

Excited states of thiophene: ring opening as deactivation mechanism.

Salzmann S, Kleinschmidt M, Tatchen J, Weinkauf R, Marian CM.

Phys Chem Chem Phys. 2008 Jan 21;10(3):380-92. doi: 10.1039/b710380h. Epub 2007 Sep 28.

PMID:
18174980
47.

Subcapital correction osteotomy in slipped capital femoral epiphysis by means of surgical hip dislocation.

Leunig M, Slongo T, Kleinschmidt M, Ganz R.

Oper Orthop Traumatol. 2007 Oct;19(4):389-410. English, German.

PMID:
17940736
48.
49.

Minocycline inhibits West Nile virus replication and apoptosis in human neuronal cells.

Michaelis M, Kleinschmidt MC, Doerr HW, Cinatl J Jr.

J Antimicrob Chemother. 2007 Nov;60(5):981-6. Epub 2007 Sep 14.

PMID:
17872917
50.

Crystal structure of the incretin-bound extracellular domain of a G protein-coupled receptor.

Parthier C, Kleinschmidt M, Neumann P, Rudolph R, Manhart S, Schlenzig D, Fanghänel J, Rahfeld JU, Demuth HU, Stubbs MT.

Proc Natl Acad Sci U S A. 2007 Aug 28;104(35):13942-7. Epub 2007 Aug 21.

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