TY - JOUR A1 - Jordan, Thomas A1 - Fechler, Nina A1 - Xu, Jingsan A1 - Brenner, Thomas J. K. A1 - Antonietti, Markus A1 - Shalom, Menny T1 - "Caffeine Doping" of Carbon/Nitrogen-Based Organic Catalysts: Caffeine as a Supramolecular Edge Modifier for the Synthesis of Photoactive Carbon Nitride Tubes JF - ChemCatChem : heterogeneous & homogeneous & bio- & nano-catalysis ; a journal of ChemPubSoc Europe N2 - An alternative method for the structure tuning of carbon nitride materials by using a supramolecular approach in combination with caffeine as lining-agent is described. The self-assembly of the precursor complex consisting of melamine and cyanuric acid can be controlled by this doping molecule in terms of morphology, electronic, and photophysical properties. Caffeine is proposed to insert as an edge-molecule eventually leading to hollow tube-like carbon nitride structures with improved efficiency of charge formation. Compared to the bulk carbon nitride, the caffeine-doped analogue possesses a higher photocatalytic activity for the degradation of rhodamineB dye. Furthermore, this approach is also shown to be suitable for the modification of carbon nitride electrodes. KW - caffeine KW - carbon nitride KW - films KW - photocatalysis KW - supramolecular chemistry Y1 - 2015 U6 - https://doi.org/10.1002/cctc.201500343 SN - 1867-3880 SN - 1867-3899 VL - 7 IS - 18 SP - 2826 EP - 2830 PB - Wiley-VCH CY - Weinheim ER - TY - JOUR A1 - Riemer, Nathanael T1 - "So it happened that we went to war because we were Zionists, and not: even though we are Jews." Nationalist-Jewish German Patriotism at the Start of World War I as Reflected in the Jüdische Rundschau JF - Historisches Jahrbuch N2 - The following article aims to show how the Zionist movement defined its loyalty to Zionism, Germany, and German culture, as well as its reaction to the First World War. Central to the Zionist movement was the "creation of a home for Jewish people secured by public law." This is why superficial examinations assume that for Zionists the conflicts of the European powers were important only as they affected the pursuit of their own political agendas, an impression intensified by their posture of reserve towards military service. Crucial for Zionist positions on the First World War are the discourses revolving around the relationship between German culture, patriotism, and loyalty within the movement. This project is conducted with the help of the Judische Rundschau (JR; Jewish Review), which functions as the official organ of the "Zionistische Vereinigung fur Deutschland" (ZVfD; Zionist Association of Germany). Y1 - 2015 SN - 0018-2621 VL - 135 SP - 412 EP - 452 PB - Alber CY - Freiburg Breisgau ER - TY - JOUR A1 - Hurley, Andrew Wright A1 - Schwarz, Anja T1 - "The greatest son of our Heimat": reading German Leichhardts across the National Socialist era JF - Journal of Australian studies N2 - The article discusses German commemorations of Ludwig Leichhardt (1813-1848) in the National Socialist era when officials, journalists, educators and writers, spurred by the double anniversary of the explorer's 125th birthday and the 90th anniversary of his disappearance, began to re-imagine the explorer's life and fate in the light of the ideological imperatives of the day. Our analysis of this period pays particular attention to how these reimagined Leichhardts emphasise or neglect some of the key elements that make up his story to this day, among them: Leichhardt's ethnicity; his sense of attachment to place and home; his homosocial relationships; his evasion of Prussian military service; his role in the British colonial project; and finally, his engagements with Aborigines. On the one hand, our analysis reveals, how Leichhardt was portrayed first on the local and, later, the national level in ways that increasingly sought to elide ambiguous aspects of his life and deeds. However, it also uncovers some of the ideological labour required to render him useful to the National Socialist cause. Often enough, these re-imagined Leichhardts escaped party politics, and cast up some of the logical inconsistencies and limits to key terms in National Socialist thinking. KW - Ludwig Leichhardt KW - National Socialism KW - exploration KW - German colonialism KW - memory studies Y1 - 2015 U6 - https://doi.org/10.1080/14443058.2015.1076025 SN - 1444-3058 SN - 1835-6419 VL - 39 IS - 4 SP - 529 EP - 545 PB - Routledge, Taylor & Francis Group CY - Abingdon ER - TY - JOUR A1 - Wiese, Heike T1 - "This migrants' babble is not a German dialect!": The interaction of standard language ideology and 'us'/'them' dichotomies in the public discourse on a multiethnolect JF - Language in society N2 - This article investigates a public debate in Germany that put a special spotlight on the interaction of standard language ideologies with social dichotomies, centering on the question of whether Kiezdeutsch, a new way of speaking in multilingual urban neighbourhoods, is a legitimate German dialect. Based on a corpus of emails and postings to media websites, I analyse central topoi in this debate and an underlying narrative on language and identity. Central elements of this narrative are claims of cultural elevation and cultural unity for an idealised standard language High German', a view of German dialects as part of a national folk culture, and the construction of an exclusive in-group of German' speakers who own this language and its dialects. The narrative provides a potent conceptual frame for the Othering of Kiezdeutsch and its speakers, and for the projection of social and sometimes racist deliminations onto the linguistic plane. KW - Standard language ideology KW - Kiezdeutsch KW - dialect KW - public discourse KW - Othering KW - racism by proxy Y1 - 2015 U6 - https://doi.org/10.1017/S0047404515000226 SN - 0047-4045 SN - 1469-8013 VL - 44 IS - 3 SP - 341 EP - 368 PB - Cambridge Univ. Press CY - New York ER - TY - JOUR A1 - Schrapers, Peer A1 - Hartmann, Tobias A1 - Kositzki, Ramona A1 - Dau, Holger A1 - Reschke, Stefan A1 - Schulzke, Carola A1 - Leimkühler, Silke A1 - Haumann, Michael T1 - 'Sulfido and Cysteine Ligation Changes at the Molybdenum Cofactor during Substrate Conversion by Formate Dehydrogenase (FDH) from Rhodobacter capsulatus JF - Inorganic chemistry N2 - Formate dehydrogenase (FDH) enzymes are attractive catalysts for potential carbon dioxide conversion applications. The FDH from Rhodobacter capsulatus (RcFDH) binds a bis-molybdopterin-guanine-dinucleotide (bis-MGD) cofactor, facilitating reversible formate (HCOO-) to CO2 oxidation. We characterized the molecular structure of the active site of wildtype RcFDH and protein variants using X-ray absorption spectroscopy (XAS) at the Mo K-edge. This approach has revealed concomitant binding of a sulfido ligand (Mo=S) and a conserved cysteine residue (S(Cys386)) to Mo(VI) in the active oxidized molybdenum cofactor (Moco), retention of such a coordination motif at Mo(V) in a chemically reduced enzyme, and replacement of only the S(Cys386) ligand by an oxygen of formate upon Mo(IV) formation. The lack of a Mo=S bond in RcFDH expressed in the absence of FdsC implies specific metal sulfuration by this bis-MGD binding chaperone. This process still functioned in the Cys386Ser variant, showing no Mo-S(Cys386) ligand, but retaining a Mo=S bond. The C386S variant and the protein expressed without FdsC were inactive in formate oxidation, supporting that both Moligands are essential for catalysis. Low-pH inhibition of RcFDH was attributed to protonation at the conserved His387, supported by the enhanced activity of the His387Met variant at low pH, whereas inactive cofactor species showed sulfido-to-oxo group exchange at the Mo ion. Our results support that the sulfido and S(Cys386) ligands at Mo and a hydrogen-bonded network including His387 are crucial for positioning, deprotonation, and oxidation of formate during the reaction cycle of RcFDH. Y1 - 2015 U6 - https://doi.org/10.1021/ic502880y SN - 0020-1669 SN - 1520-510X VL - 54 IS - 7 SP - 3260 EP - 3271 PB - American Chemical Society CY - Washington ER - TY - JOUR A1 - Paz, Cristian A1 - Becerra, Jose A1 - Silva, Mario A1 - Burgos, Viviana A1 - Heydenreich, Matthias A1 - Schmidt, Bernd A1 - Thu Tran, A1 - Vetter, Irina T1 - (-)-Pentylsedinine, a New Alkaloid from the Leaves of Lobelia tupa with Agonist Activity at Nicotinic Acetylcholine Receptor JF - Natural product communications : an international journal for communications and reviews N2 - Lobelia tupa, also called devil's tobacco, is a native plant from the center-south of Chile which has been used by the native people of Chile as a hallucinogenic and anesthetic plant. A new piperidine alkaloid, called pentylsedinine, which comprises five carbons in the side chain, was isolated from the aerial part of L. tupa, along with lobeline and lobelanidine. The structure was established on the basis of 1D and 2D NMR spectroscopy. While lobeline is a neutral antagonist at alpha 3 beta 2/alpha 3 beta 4 nAChR and alpha 7 nAChR, both lobelanidine and pentylsedinine act as partial agonists at nAChR KW - Lobelia tupa KW - Piperidine alkaloid KW - nAChR KW - Pentylsedinine Y1 - 2015 SN - 1934-578X SN - 1555-9475 VL - 10 IS - 8 SP - 1355 EP - 1357 PB - NPC CY - Westerville ER - TY - JOUR A1 - Shaki, Samuel A1 - Sery, Noa A1 - Fischer, Martin H. T1 - 1 + 2 is more than 2 + 1: Violations of commutativity and identity axioms in mental arithmetic JF - Journal of cognitive psychology N2 - Over the past decade or so, a large number of studies have revealed that conceptual meaning is sensitive to situational context. More recently, similar contextual influences have been documented in the domain of number knowledge. Here we show such context dependency in a length production task. Adult participants saw single digit addition problems of the form n1 + n2 and produced the sum by changing bi-directionally the length of a horizontally extended line, using radially arranged buttons. We found that longer lines were produced when n1 < n2 compared to n1 > n2 and that unit size increased with result size. Thus, the mathematical axioms of commutativity and identity do not seem to hold in mental addition. We discuss implications of these observations for our understanding of cognitive mechanisms involved in mental arithmetic and for situated cognition generally. KW - Operand order effect KW - Situated cognition KW - Mental number line KW - SNARC KW - Operational momentum Y1 - 2015 U6 - https://doi.org/10.1080/20445911.2014.973414 SN - 2044-5911 SN - 2044-592X VL - 27 IS - 4 SP - 471 EP - 477 PB - Routledge, Taylor & Francis Group CY - Abingdon ER - TY - THES A1 - Bendadani, Carolin T1 - 1-Methylpyren: Biotransformation und Gentoxizität Y1 - 2015 ER - TY - JOUR A1 - Kolocouris, Antonios A1 - Koch, Andreas A1 - Kleinpeter, Erich A1 - Stylianakis, Ioannis T1 - 2-Substituted and 2,2-disubstituted adamantane derivatives as models for studying substituent chemical shifts and C-H-ax center dot center dot center dot Y-ax cyclohexane contacts-results from experimental and theoretical NMR spectroscopic chemical shifts and DFT structures JF - Tetrahedron N2 - The complete H-1 and C-13 NMR chemical shifts assignment for various 2-substituted and 2,2-disubstituted adamantane derivatives 1-38 in CDCl3 solution was realized on the basis of NMR experiments combined with chemical structure information and DFT-GIAO (B3LYP/6-31+G(d,p)-GIAO) calculations of chemical shifts in solution. Substituent-induced C-13 NMR chemical shifts (SCS) are discussed. C-H-ax center dot center dot center dot Y-ax contacts are a textbook prototype of steric hindrance in organic chemistry. The nature of these contacts will be further investigated in this work on basis of new adamantane derivatives, which are substituted at C-2 to provide models for 1,4-C-H-ax center dot center dot center dot Y-ax and 1,5-C-H-ax center dot center dot center dot Y-ax contacts. The B3LYP/6-31+G(d,p) calculations predicted the presence of NBO hyperconjugative attractive interactions between C-H-ax and Y-ax groups along C-H-ax center dot center dot center dot Y-ax contacts. The H-1 NMR signal separation, Delta delta(gamma-CH2), reflects the strength of the H-bonded C-H-ax center dot center dot center dot Y-ax contact. (C) 2015 Elsevier Ltd. All rights reserved. KW - 2-Substituted adamantane derivatives KW - 2,2-Disubstituted adamantane derivatives KW - H-1 NMR KW - C-13 NMR KW - B3LYP/6-31+G(d,p) calculations KW - GIAO calculations KW - Substituent chemical shifts Y1 - 2015 U6 - https://doi.org/10.1016/j.tet.2015.01.044 SN - 0040-4020 VL - 71 IS - 16 SP - 2463 EP - 2481 PB - Elsevier CY - Oxford ER - TY - BOOK ED - Gunnarsson, Logi ED - Zimmermann, Andreas T1 - 20 Jahre MenschenRechtsZentrum Y1 - 2015 PB - BWV Berliner Wissenschafts-Verlag CY - Berlin ER - TY - JOUR A1 - Evans, Chris J. A1 - van Loon, Jacco Th A1 - Hainich, Rainer A1 - Bailey, M. T1 - 2dF-AAOmega spectroscopy of massive stars in the Magellanic Clouds The north-eastern region of the Large Magellanic Cloud JF - Astronomy and astrophysics : an international weekly journal N2 - We present spectral classifications from optical spectroscopy of 263 massive stars in the north-eastern region of the Large Magellanic Cloud. The observed two-degree field includes the massive 30 Doradus star-forming region, the environs of SN1987A, and a number of star-forming complexes to the south of 30 Dor. These are the first classifications for the majority (203) of the stars and include eleven double-lined spectroscopic binaries. The sample also includes the first examples of early OC-type spectra (AA Omega 30 Dor 248 and 280), distinguished by the weakness of their nitrogen spectra and by C IV lambda 4658 emission. We propose that these stars have relatively unprocessed CNO abundances compared to morphologically normal O-type stars, indicative of an earlier evolutionary phase. From analysis of observations obtained on two consecutive nights, we present radial-velocity estimates for 233 stars, finding one apparent single-lined binary and nine (>3 sigma) outliers compared to the systemic velocity; the latter objects could be runaway stars or large-amplitude binary systems and further spectroscopy is required to investigate their nature. KW - Magellanic Clouds KW - stars: early-type KW - stars: fundamental parameters KW - open clusters and associations: general Y1 - 2015 U6 - https://doi.org/10.1051/0004-6361/201525882 SN - 1432-0746 VL - 584 PB - EDP Sciences CY - Les Ulis ER - TY - THES A1 - Balk, Maria T1 - 3D structured shape-memory hydrogels with enzymatically-induced shape shifting Y1 - 2015 ER - TY - JOUR A1 - Allroggen, Niklas A1 - van Schaik, N. Loes M. B. A1 - Tronicke, Jens T1 - 4D ground-penetrating radar during a plot scale dye tracer experiment JF - Journal of applied geophysics N2 - Flow phenomena in the unsaturated zone are highly variable in time and space. Thus, it is challenging to measure and monitor such processes under field conditions. Here, we present a new setup and interpretation approach for combining a dye tracer experiment with a 4D ground-penetrating radar (GPR) survey. Therefore, we designed a rainfall experiment during which we measured three surface-based 3D GPR surveys using a pair of 500 MHz antennas. Such a survey setup requires accurate acquisition and processing techniquesto extract time-lapse information supporting the interpretation of selected cross-sections photographed after excavating the site. Our results reveal patterns of traveltime changes in the measured GPR data, which are associated with soil moisture changes. As distinct horizons are present at our site, such changes can be quantified and transferred into changes in total soil moisture content. Our soil moisture estimates are similar to the amount of infiltrated water, which confirms our experimental approach and makes us confident for further developing this strategy, especially, with respect to improving the temporal and spatial resolution. (C) 2015 Elsevier B.V. All rights reserved. KW - Ground penetrating radar KW - Time-lapse imaging KW - Brilliant blue Y1 - 2015 U6 - https://doi.org/10.1016/j.jappgeo.2015.04.016 SN - 0926-9851 SN - 1879-1859 VL - 118 SP - 139 EP - 144 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Wichura, Henry A1 - Jacobs, Louis L. A1 - Lin, Andrew A1 - Polcyn, Michael J. A1 - Manthi, Fredrick K. A1 - Winkler, Dale A. A1 - Strecker, Manfred A1 - Clemens, Matthew T1 - A 17-My-old whale constrains onset of uplift and climate change in east Africa JF - Proceedings of the National Academy of Sciences of the United States of America N2 - Timing and magnitude of surface uplift are key to understanding the impact of crustal deformation and topographic growth on atmospheric circulation, environmental conditions, and surface processes. Uplift of the East African Plateau is linked to mantle processes, but paleoaltimetry data are too scarce to constrain plateau evolution and subsequent vertical motions associated with rifting. Here, we assess the paleotopographic implications of a beaked whale fossil (Ziphiidae) from the Turkana region of Kenya found 740 km inland from the present-day coastline of the Indian Ocean at an elevation of 620 m. The specimen is similar to 17 My old and represents the oldest derived beaked whale known, consistent with molecular estimates of the emergence of modern straptoothed whales (Mesoplodon). The whale traveled from the Indian Ocean inland along an eastward-directed drainage system controlled by the Cretaceous Anza Graben and was stranded slightly above sea level. Surface uplift from near sea level coincides with paleoclimatic change from a humid environment to highly variable and much drier conditions, which altered biotic communities and drove evolution in east Africa, including that of primates. KW - east Africa KW - Ziphiidae KW - uplift KW - drainage KW - paleoenvironment Y1 - 2015 U6 - https://doi.org/10.1073/pnas.1421502112 SN - 0027-8424 VL - 112 IS - 13 SP - 3910 EP - 3915 PB - National Acad. of Sciences CY - Washington ER - TY - INPR A1 - Petroczi, Andrea A1 - Backhouse, Susan H. A1 - Barkoukis, Vassilis A1 - Brand, Ralf A1 - Elbe, Anne-Marie A1 - Lazuras, Larnbros A1 - Lucidi, Fabio T1 - A call for policy guidance on psychometric testing in doping control in sport T2 - International journal of drug policy N2 - One of the fundamental challenges in anti-doping is identifying athletes who use, or are at risk of using, prohibited performance enhancing substances. The growing trend to employ a forensic approach to doping control aims to integrate information from social sciences (e.g., psychology of doping) into organised intelligence to protect clean sport. Beyond the foreseeable consequences of a positive identification as a doping user, this task is further complicated by the discrepancy between what constitutes a doping offence in the World Anti-Doping Code and operationalized in doping research. Whilst psychology plays an important role in developing our understanding of doping behaviour in order to inform intervention and prevention, its contribution to the array of doping diagnostic tools is still in its infancy. In both research and forensic settings, we must acknowledge that (1) socially desirable responding confounds self-reported psychometric test results and (2) that the cognitive complexity surrounding test performance means that the response-time based measures and the lie detector tests for revealing concealed life-events (e.g., doping use) are prone to produce false or non-interpretable outcomes in field settings. Differences in social-cognitive characteristics of doping behaviour that are tested at group level (doping users vs. non-users) cannot be extrapolated to individuals; nor these psychometric measures used for individual diagnostics. In this paper, we present a position statement calling for policy guidance on appropriate use of psychometric assessments in the pursuit of clean sport. We argue that, to date, both self-reported and response-time based psychometric tests for doping have been designed, tested and validated to explore how athletes feel and think about doping in order to develop a better understanding of doping behaviour, not to establish evidence for doping. A false 'positive' psychological profile for doping affects not only the individual 'clean' athlete but also their entourage, their organisation and sport itself. The proposed policy guidance aims to protect the global athletic community against social, ethical and legal consequences from potential misuse of psychological tests, including erroneous or incompetent applications as forensic diagnostic tools in both practice and research. (C) 2015 Elsevier B.V. All rights reserved. KW - Prohibited performance enhancement KW - Athlete KW - Drug KW - Anti-doping KW - Attitude Y1 - 2015 U6 - https://doi.org/10.1016/j.drugpo.2015.04.022 SN - 0955-3959 SN - 1873-4758 VL - 26 IS - 11 SP - 1130 EP - 1139 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Benina, Maria A1 - Ribeiro, Dimas Mendes A1 - Gechev, Tsanko S. A1 - Müller-Röber, Bernd A1 - Schippers, Jos H. M. T1 - A cell type-specific view on the translation of mRNAs from ROS-responsive genes upon paraquat treatment of Arabidopsis thaliana leaves JF - Plant, cell & environment : cell physiology, whole-plant physiology, community physiology N2 - Oxidative stress causes dramatic changes in the expression levels of many genes. The formation of a functional protein through successful mRNA translation is central to a coordinated cellular response. To what extent the response towards reactive oxygen species (ROS) is regulated at the translational level is poorly understood. Here we analysed leaf- and tissue-specific translatomes using a set of transgenic Arabidopsis thaliana lines expressing a FLAG-tagged ribosomal protein to immunopurify polysome-bound mRNAs before and after oxidative stress. We determined transcript levels of 171 ROS-responsive genes upon paraquat treatment, which causes formation of superoxide radicals, at the whole-organ level. Furthermore, the translation of mRNAs was determined for five cell types: mesophyll, bundle sheath, phloem companion, epidermal and guard cells. Mesophyll and bundle sheath cells showed the strongest response to paraquat treatment. Interestingly, several ROS-responsive transcription factors displayed cell type-specific translation patterns, while others were translated in all cell types. In part, cell type-specific translation could be explained by the length of the 5-untranslated region (5-UTR) and the presence of upstream open reading frames (uORFs). Our analysis reveals insights into the translational regulation of ROS-responsive genes, which is important to understanding cell-specific responses and functions during oxidative stress. The study illustrates the response of different Arabidopsis thaliana leaf cells and tissues to oxidative stress at the translational level, an aspect of reactive oxygen species (ROS) biology that has been little studied in the past. Our data reveal insights into how translational regulation of ROS-responsive genes is fine-tuned at the cellular level, a phenomenon contributing to the integrated physiological response of leaves to stresses involving changes in ROS levels. KW - Arabidopsis KW - gene regulation KW - oxidative stress KW - tissue-specific KW - translation Y1 - 2015 U6 - https://doi.org/10.1111/pce.12355 SN - 0140-7791 SN - 1365-3040 VL - 38 IS - 2 SP - 349 EP - 363 PB - Wiley-Blackwell CY - Hoboken ER - TY - JOUR A1 - Fedchenko, Dmitry A1 - Tarkhanov, Nikolai Nikolaevich T1 - A Class of Toeplitz Operators in Several Variables JF - Advances in applied Clifford algebras N2 - We introduce the concept of Toeplitz operator associated with the Laplace-Beltrami operator on a compact Riemannian manifold with boundary. We characterise those Toeplitz operators which are Fredholm, thus initiating the index theory. KW - Cauchy data spaces KW - Laplace-Beltrami operator KW - Toeplitz operators KW - Fredholm property Y1 - 2015 U6 - https://doi.org/10.1007/s00006-015-0546-9 SN - 0188-7009 SN - 1661-4909 VL - 25 IS - 4 SP - 811 EP - 828 PB - Springer CY - Basel ER - TY - JOUR A1 - Ehlert, Christopher A1 - Kröner, Dominik A1 - Saalfrank, Peter T1 - A combined quantum chemical/molecular dynamics study of X-ray photoelectron spectra of polyvinyl alcohol using oligomer models JF - Journal of electron spectroscopy and related phenomena : the international journal on theoretical and experimental aspects of electron spectroscopy N2 - X-ray photoelectron spectroscopy (XPS) is a powerful tool for probing the local chemical environment of atoms near surfaces. When applied to soft matter, such as polymers, XPS spectra are frequently shifted and broadened due to thermal atom motion and by interchain interactions. We present a combined quantum mechanical QM/molecular dynamics (MD) simulation of X-ray photoelectron spectra of polyvinyl alcohol (PVA) using oligomer models in order to account for and quantify these effects on the XPS (C1s) signal. In our study, molecular dynamics at finite temperature were performed with a classical forcefield and by ab initio MD (AIMD) using the Car-Parrinello method. Snapshots along, the trajectories represent possible conformers and/or neighbouring environments, with different C1s ionization potentials for individual C atoms leading to broadened XPS peaks. The latter are determined by Delta-Kohn Sham calculations. We also examine the experimental practice of gauging XPS (C1s) signals of alkylic C-atoms in C-containing polymers to the C1s signal of polyethylene. We find that (i) the experimental XPS (C1s) spectra of PVA (position and width) can be roughly represented by single-strand models, (ii) interchain interactions lead to red-shifts of the XPS peaks by about 0.6 eV, and (iii) AIMD simulations match the findings from classical MD semi-quantitatively. Further, (iv) the gauging procedure of XPS (C1s) signals to the values of PE, introduces errors of about 0.5 eV. (C) 2014 Elsevier B.V. All rights reserved. KW - Simulation of polymer XPS KW - Delta-Kohn Sham method KW - Thermal broadening effects KW - Interchain interactions KW - Classical MD KW - Poly vinyl alcohol Y1 - 2015 U6 - https://doi.org/10.1016/j.elspec.2014.12.007 SN - 0368-2048 SN - 1873-2526 VL - 199 SP - 38 EP - 45 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Wiggering, Hubert A1 - Steinhardt, Uta T1 - A conceptual model for site-specific agricultural land-use JF - Ecological modelling : international journal on ecological modelling and engineering and systems ecolog N2 - Land-use concepts provide decision support for the most efficient usage options according to sustainable development and multifunctionality requirements. However, developments in landscape-related, agricultural production schemes are primarily driven by economic benefits. Therefore, most agricultural land-use concepts tackle particular problems or interests and lack a systemic perspective. As a result, we discuss a conceptual model for future site-specific agricultural land-use with an inbuilt requirement for adequate experimental sites to enable monitoring systems for a new generation of ecosystem models and for new approaches to address science-stakeholder interactions. KW - Site-specific agricultural land-use KW - Concept of differentiated land use KW - Sustainable land use KW - Multifunctionality KW - Modeling tools for decision-making Y1 - 2015 U6 - https://doi.org/10.1016/j.ecolmodel.2014.08.011 SN - 0304-3800 SN - 1872-7026 VL - 295 SP - 42 EP - 46 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Mühlenbruch, Kristin A1 - Kuxhaus, Olga A1 - Pencina, Michael J. A1 - Boeing, Heiner A1 - Liero, Hannelore A1 - Schulze, Matthias Bernd T1 - A confidence ellipse for the Net Reclassification Improvement JF - European journal of epidemiology N2 - The Net Reclassification Improvement (NRI) has become a popular metric for evaluating improvement in disease prediction models through the past years. The concept is relatively straightforward but usage and interpretation has been different across studies. While no thresholds exist for evaluating the degree of improvement, many studies have relied solely on the significance of the NRI estimate. However, recent studies recommend that statistical testing with the NRI should be avoided. We propose using confidence ellipses around the estimated values of event and non-event NRIs which might provide the best measure of variability around the point estimates. Our developments are illustrated using practical examples from EPIC-Potsdam study. KW - Risk assessment KW - Risk model KW - Model comparison KW - Reclassification KW - Confidence intervals Y1 - 2015 U6 - https://doi.org/10.1007/s10654-015-0001-1 SN - 0393-2990 SN - 1573-7284 VL - 30 IS - 4 SP - 299 EP - 304 PB - Springer CY - Dordrecht ER - TY - JOUR A1 - Corcoran, Michael F. A1 - Nichols, Joy S. A1 - Pablo, Herbert A1 - Shenar, Tomer A1 - Pollock, Andy M. T. A1 - Waldron, Wayne L. A1 - Moffat, Anthony F. J. A1 - Richardson, Noel D. A1 - Russell, Christopher M. P. A1 - Hamaguchi, Kenji A1 - Huenemoerder, David P. A1 - Oskinova, Lida A1 - Hamann, Wolf-Rainer A1 - Naze, Yael A1 - Ignace, Richard A1 - Evans, Nancy Remage A1 - Lomax, Jamie R. A1 - Hoffman, Jennifer L. A1 - Gayley, Kenneth A1 - Owocki, Stanley P. A1 - Leutenegger, Maurice A1 - Gull, Theodore R. A1 - Hole, Karen Tabetha A1 - Lauer, Jennifer A1 - Iping, Rosina C. T1 - A coordinated X-Ray and optical campaign of the nearest massive eclipsing binary, delta ORIONIS Aa. I. Overview of thr X-Ray spectrum JF - The astrophysical journal : an international review of spectroscopy and astronomical physics N2 - We present an overview of four deep phase-constrained Chandra HETGS X-ray observations of delta Ori A. Delta Ori A is actually a triple system that includes the nearest massive eclipsing spectroscopic binary, delta Ori Aa, the only such object that can be observed with little phase-smearing with the Chandra gratings. Since the fainter star, delta Ori Aa2, has a much lower X-ray luminosity than the brighter primary (delta Ori Aa1), delta Ori Aa provides a unique system with which to test the spatial distribution of the X-ray emitting gas around delta Ori Aa1 via occultation by the photosphere of, and wind cavity around, the X-ray dark secondary. Here we discuss the X-ray spectrum and X-ray line profiles for the combined observation, having an exposure time of nearly 500 ks and covering nearly the entire binary orbit. The companion papers discuss the X-ray variability seen in the Chandra spectra, present new space-based photometry and ground-based radial velocities obtained simultaneously with the X-ray data to better constrain the system parameters, and model the effects of X-rays on the optical and UV spectra. We find that the X-ray emission is dominated by embedded wind shock emission from star Aa1, with little contribution from the tertiary star Ab or the shocked gas produced by the collision of the wind of Aa1 against the surface of Aa2. We find a similar temperature distribution to previous X-ray spectrum analyses. We also show that the line half-widths are about 0.3-0.5 times the terminal velocity of the wind of star Aa1. We find a strong anti-correlation between line widths and the line excitation energy, which suggests that longer-wavelength, lower-temperature lines form farther out in the wind. Our analysis also indicates that the ratio of the intensities of the strong and weak lines of Fe XVII and Ne X are inconsistent with model predictions, which may be an effect of resonance scattering. KW - binaries: close KW - binaries: eclipsing KW - stars: early-type KW - stars: individual (Delta Ori) KW - stars: mass-loss KW - X-rays: stars Y1 - 2015 U6 - https://doi.org/10.1088/0004-637X/809/2/132 SN - 0004-637X SN - 1538-4357 VL - 809 IS - 2 PB - IOP Publ. Ltd. CY - Bristol ER - TY - JOUR A1 - Nichols, Joy A1 - Huenemoerder, David P. A1 - Corcoran, Michael F. A1 - Waldron, Wayne A1 - Naze, Yael A1 - Pollock, Andy M. T. A1 - Moffat, Anthony F. J. A1 - Lauer, Jennifer A1 - Shenar, Tomer A1 - Russell, Christopher M. P. A1 - Richardson, Noel D. A1 - Pablo, Herbert A1 - Evans, Nancy Remage A1 - Hamaguchi, Kenji A1 - Gull, Theodore A1 - Hamann, Wolf-Rainer A1 - Oskinova, Lida A1 - Ignace, Rosina A1 - Hoffman, Jennifer L. A1 - Hole, Karen Tabetha A1 - Lomax, Jamie R. T1 - A COORDINATED X-RAY AND OPTICAL CAMPAIGN OF THE NEAREST MASSIVE ECLIPSING BINARY, delta ORIONIS Aa. II. X-RAY VARIABILITY JF - The astrophysical journal : an international review of spectroscopy and astronomical physics N2 - We present time-resolved and phase-resolved variability studies of an extensive X-ray high-resolution spectral data set of the delta Ori Aa binary system. The four observations, obtained with Chandra ACIS HETGS, have a total exposure time of approximate to 479 ks and provide nearly complete binary phase coverage. Variability of the total X-ray flux in the range of 5-25 is is confirmed, with a maximum amplitude of about +/- 15% within a single approximate to 125 ks observation. Periods of 4.76 and 2.04 days are found in the total X-ray flux, as well as an apparent overall increase in the flux level throughout the nine-day observational campaign. Using 40 ks contiguous spectra derived from the original observations, we investigate the variability of emission line parameters and ratios. Several emission lines are shown to be variable, including S XV, Si XIII, and Ne IX. For the first time, variations of the X-ray emission line widths as a function of the binary phase are found in a binary system, with the smallest widths at phi = 0.0 when the secondary delta Ori Aa2 is at the inferior conjunction. Using 3D hydrodynamic modeling of the interacting winds, we relate the emission line width variability to the presence of a wind cavity created by a wind-wind collision, which is effectively void of embedded wind shocks and is carved out of the X-ray-producing primary wind, thus producing phase-locked X-ray variability. KW - binaries: close KW - binaries: eclipsing KW - stars: individual ([HD 36486]delta Ori A) Y1 - 2015 U6 - https://doi.org/10.1088/0004-637X/809/2/133 SN - 0004-637X SN - 1538-4357 VL - 809 IS - 2 PB - IOP Publ. Ltd. CY - Bristol ER - TY - JOUR A1 - Pablo, Herbert A1 - Richardson, Noel D. A1 - Moffat, Anthony F. J. A1 - Corcoran, Michael A1 - Shenar, Tomer A1 - Benvenuto, Omar A1 - Fuller, Jim A1 - Naze, Yael A1 - Hoffman, Jennifer L. A1 - Miroshnichenko, Anatoly A1 - Apellaniz, Jesus Maiz A1 - Evans, Nancy A1 - Eversberg, Thomas A1 - Gayley, Ken A1 - Gull, Ted A1 - Hamaguchi, Kenji A1 - Hamann, Wolf-Rainer A1 - Henrichs, Huib A1 - Hole, Tabetha A1 - Ignace, Richard A1 - Iping, Rosina A1 - Lauer, Jennifer A1 - Leutenegger, Maurice A1 - Lomax, Jamie A1 - Nichols, Joy A1 - Oskinova, Lida A1 - Owocki, Stan A1 - Pollock, Andy A1 - Russell, Christopher M. P. A1 - Waldron, Wayne A1 - Buil, Christian A1 - Garrel, Thierry A1 - Graham, Keith A1 - Heathcote, Bernard A1 - Lemoult, Thierry A1 - Li, Dong A1 - Mauclaire, Benjamin A1 - Potter, Mike A1 - Ribeiro, Jose A1 - Matthews, Jaymie A1 - Cameron, Chris A1 - Guenther, David A1 - Kuschnig, Rainer A1 - Rowe, Jason A1 - Rucinski, Slavek A1 - Sasselov, Dimitar A1 - Weiss, Werner T1 - A coordinated X-Ray and optical campaign of the nearest massive eclipsing binary, delta ORIONIS Aa. III. Analysis of optical photometric (most) and spectroscopic (ground based) variations JF - The astrophysical journal : an international review of spectroscopy and astronomical physics N2 - We report on both high-precision photometry from the Microvariability and Oscillations of Stars (MOST) space telescope and ground-based spectroscopy of the triple system delta Ori A, consisting of a binary O9.5II+early-B (Aa1 and Aa2) with P = 5.7 days, and a more distant tertiary (O9 IV P > 400 years). This data was collected in concert with X-ray spectroscopy from the Chandra X-ray Observatory. Thanks to continuous coverage for three weeks, the MOST light curve reveals clear eclipses between Aa1 and Aa2 for the first time in non-phased data. From the spectroscopy, we have a well-constrained radial velocity (RV) curve of Aa1. While we are unable to recover RV variations of the secondary star, we are able to constrain several fundamental parameters of this system and determine an approximate mass of the primary using apsidal motion. We also detected second order modulations at 12 separate frequencies with spacings indicative of tidally influenced oscillations. These spacings have never been seen in a massive binary, making this system one of only a handful of such binaries that show evidence for tidally induced pulsations. KW - binaries: close KW - binaries: eclipsing KW - stars: early-type KW - stars: individual (delta Ori A) KW - stars: mass-loss KW - stars: variables: general Y1 - 2015 U6 - https://doi.org/10.1088/0004-637X/809/2/134 SN - 0004-637X SN - 1538-4357 VL - 809 IS - 2 PB - IOP Publ. Ltd. CY - Bristol ER - TY - JOUR A1 - Shenar, Tomer A1 - Oskinova, Lida A1 - Hamann, Wolf-Rainer A1 - Corcoran, Michael F. A1 - Moffat, Anthony F. J. A1 - Pablo, Herbert A1 - Richardson, Noel D. A1 - Waldron, Wayne L. A1 - Huenemoerder, David P. A1 - Maiz Apellaniz, Jesus A1 - Nichols, Joy S. A1 - Todt, Helge Tobias A1 - Naze, Yael A1 - Hoffman, Jennifer L. A1 - Pollock, Andy M. T. A1 - Negueruela, Ignacio T1 - A coordinated X-Ray and optical campaign of the nearest massive eclipsing binary, delta ORIONIS Aa. IV. A multiwavelength, non-lte spectroscopic analysis JF - The astrophysical journal : an international review of spectroscopy and astronomical physics N2 - Eclipsing systems of massive stars allow one to explore the properties of their components in great detail. We perform a multi-wavelength, non-LTE analysis of the three components of the massive multiple system delta Ori A, focusing on the fundamental stellar properties, stellar winds, and X-ray characteristics of the system. The primary's distance-independent parameters turn out to be characteristic for its spectral type (O9.5 II), but usage of the Hipparcos parallax yields surprisingly low values for the mass, radius, and luminosity. Consistent values follow only if delta Ori lies at about twice the Hipparcos distance, in the vicinity of the sigma-Orionis cluster. The primary and tertiary dominate the spectrum and leave the secondary only marginally detectable. We estimate the V-band magnitude difference between primary and secondary to be Delta V approximate to 2.(m)8. The inferred parameters suggest that the secondary is an early B-type dwarf (approximate to B1 V), while the tertiary is an early B-type subgiant (approximate to B0 IV). We find evidence for rapid turbulent velocities (similar to 200 km s(-1)) and wind inhomogeneities, partially optically thick, in the primary's wind. The bulk of the X-ray emission likely emerges from the primary's stellar wind (logL(X)/L-Bol approximate to -6.85), initiating close to the stellar surface at R-0 similar to 1.1 R-*. Accounting for clumping, the mass-loss rate of the primary is found to be log (M) over dot approximate to -6.4 (M-circle dot yr(-1))., which agrees with hydrodynamic predictions, and provides a consistent picture along the X-ray, UV, optical, and radio spectral domains. KW - binaries: close KW - binaries: eclipsing KW - stars: early-type KW - stars: individual ([HD 36486]delta Ori A) KW - X-rays: stars Y1 - 2015 U6 - https://doi.org/10.1088/0004-637X/809/2/135 SN - 0004-637X SN - 1538-4357 VL - 809 IS - 2 PB - IOP Publ. Ltd. CY - Bristol ER - TY - JOUR A1 - Park, Jaeheung A1 - Stolle, Claudia A1 - Xiong, Chao A1 - Lühr, Hermann A1 - Pfaff, Robert F. A1 - Buchert, Stephan A1 - Martinis, Carlos R. T1 - A dayside plasma depletion observed at midlatitudes during quiet geomagnetic conditions JF - Geophysical research letters N2 - In this study we investigate a dayside, midlatitude plasma depletion (DMLPD) encountered on 22 May 2014 by the Swarm and GRACE satellites, as well as ground-based instruments. The DMLPD was observed near Puerto Rico by Swarm near 10 LT under quiet geomagnetic conditions at altitudes of 475-520 km and magnetic latitudes of similar to 25 degrees-30 degrees. The DMLPD was also revealed in total electron content observations by the Saint Croix station and by the GRACE satellites (430 km) near 16 LT and near the same geographic location. The unique Swarm constellation enables the horizontal tilt of the DMLPD to be measured (35 degrees clockwise from the geomagnetic east-west direction). Ground-based airglow images at Arecibo showed no evidence for plasma density depletions during the night prior to this dayside event. The C/NOFS equatorial satellite showed evidence for very modest plasma density depletions that had rotated into the morningside from nightside. However, the equatorial depletions do not appear related to the DMLPD, for which the magnetic apex height is about 2500 km. The origins of the DMLPD are unknown, but may be related to gravity waves. Y1 - 2015 U6 - https://doi.org/10.1002/2014GL062655 SN - 0094-8276 SN - 1944-8007 VL - 42 IS - 4 SP - 967 EP - 974 PB - American Geophysical Union CY - Washington ER - TY - JOUR A1 - Tötzke, Christian A1 - Manke, Ingo A1 - Gaiselmann, Gerd A1 - Bohner, John A1 - Müller, Bernd R. A1 - Kupsch, Andreas A1 - Hentschel, Manfred P. A1 - Schmidt, Volker A1 - Banhart, Jens A1 - Lehnert, Werner T1 - A dedicated compression device for high resolution X-ray tomography of compressed gas diffusion layers JF - Review of scientific instruments : a monthly journal devoted to scientific instruments, apparatus, and techniques N2 - We present an experimental approach to study the three-dimensional microstructure of gas diffusion layer (GDL) materials under realistic compression conditions. A dedicated compression device was designed that allows for synchrotron-tomographic investigation of circular samples under well-defined compression conditions. The tomographic data provide the experimental basis for stochastic modeling of nonwoven GDL materials. A plain compression tool is used to study the fiber courses in the material at different compression stages. Transport relevant geometrical parameters, such as porosity, pore size, and tortuosity distributions, are exemplarily evaluated for a GDL sample in the uncompressed state and for a compression of 30 vol.%. To mimic the geometry of the flow-field, we employed a compression punch with an integrated channel-rib-profile. It turned out that the GDL material is homogeneously compressed under the ribs, however, much less compressed underneath the channel. GDL fibers extend far into the channel volume where they might interfere with the convective gas transport and the removal of liquid water from the cell. (C) 2015 AIP Publishing LLC. Y1 - 2015 U6 - https://doi.org/10.1063/1.4918291 SN - 0034-6748 SN - 1089-7623 VL - 86 IS - 4 PB - American Institute of Physics CY - Melville ER - TY - JOUR A1 - Busch, Jan Philip A1 - Meißner, Tobias A1 - Potthoff, Annegret A1 - Bleyl, Steffen A1 - Georgi, Anett A1 - Mackenzie, Katrin A1 - Trabitzsch, Ralf A1 - Werban, Ulrike A1 - Oswald, Sascha T1 - A field investigation on transport of carbon-supported nanoscale zero-valent iron (nZVI) in groundwater JF - Journal of contaminant hydrology N2 - The application of nanoscale zero-valent iron (nZVI) for subsurface remediation of groundwater contaminants is a promising new technology, which can be understood as alternative to the permeable reactive barrier technique using granular iron. Dechlorination of organic contaminants by zero-valent iron seems promising. Currently, one limitation to widespread deployment is the fast agglomeration and sedimentation of nZVI in colloidal suspensions, even more so when in soils and sediments, which limits the applicability for the treatment of sources and plumes of contamination. Colloid-supported nZVI shows promising characteristics to overcome these limitations. Mobility of Carbo-Iron Colloids (CIC) - a newly developed composite material based on finely ground activated carbon as a carrier for nZVI - was tested in a field application: In this study, a horizontal dipole flow field was established between two wells separated by 53 m in a confined, natural aquifer. The injection/extraction rate was 500 L/h. Approximately 12 kg of CIC was suspended with the polyanionic stabilizer carboxymethyl cellulose. The suspension was introduced into the aquifer at the injection well. Breakthrough of CIC was observed visually and based on total particle and iron concentrations detected in samples from the extraction well. Filtration of water samples revealed a particle breakthrough of about 12% of the amount introduced. This demonstrates high mobility of CIC particles and we suggest that nZVI carried on CIC can be used for contaminant plume remediation by in-situ formation of reactive barriers. (C) 2015 Elsevier B.V. All rights reserved. KW - Nanoscale zero-valent iron (nZVI) KW - Fe-C composite KW - Carbon colloid KW - Field aquifer KW - Remediation KW - Particle mobility Y1 - 2015 U6 - https://doi.org/10.1016/j.jconhyd.2015.03.009 SN - 0169-7722 SN - 1873-6009 VL - 181 SP - 59 EP - 68 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Röthlein, Christoph A1 - Miettinen, Markus S. A1 - Ignatova, Zoya T1 - A flexible approach to assess fluorescence decay functions in complex energy transfer systems JF - BMC biophysics N2 - Background: Time-correlated Forster resonance energy transfer (FRET) probes molecular distances with greater accuracy than intensity-based calculation of FRET efficiency and provides a powerful tool to study biomolecular structure and dynamics. Moreover, time-correlated photon count measurements bear additional information on the variety of donor surroundings allowing more detailed differentiation between distinct structural geometries which are typically inaccessible to general fitting solutions. Results: Here we develop a new approach based on Monte Carlo simulations of time-correlated FRET events to estimate the time-correlated single photon counts (TCSPC) histograms in complex systems. This simulation solution assesses the full statistics of time-correlated photon counts and distance distributions of fluorescently labeled biomolecules. The simulations are consistent with the theoretical predictions of the dye behavior in FRET systems with defined dye distances and measurements of randomly distributed dye solutions. We validate the simulation results using a highly heterogeneous aggregation system and explore the conditions to use this tool in complex systems. Conclusion: This approach is powerful in distinguishing distance distributions in a wide variety of experimental setups, thus providing a versatile tool to accurately distinguish between different structural assemblies in highly complex systems. KW - Time resolved FRET KW - Monte-Carlo simulations KW - Complex heterogeneous systems KW - Protein aggregation Y1 - 2015 U6 - https://doi.org/10.1186/s13628-015-0020-z SN - 2046-1682 VL - 8 PB - BioMed Central CY - London ER - TY - JOUR A1 - Frieler, Katja A1 - Levermann, Anders A1 - Elliott, J. A1 - Heinke, Jens A1 - Arneth, A. A1 - Bierkens, M. F. P. A1 - Ciais, Philippe A1 - Clark, D. B. A1 - Deryng, D. A1 - Doell, P. A1 - Falloon, P. A1 - Fekete, B. A1 - Folberth, Christian A1 - Friend, A. D. A1 - Gellhorn, C. A1 - Gosling, S. N. A1 - Haddeland, I. A1 - Khabarov, N. A1 - Lomas, M. A1 - Masaki, Y. A1 - Nishina, K. A1 - Neumann, K. A1 - Oki, T. A1 - Pavlick, R. A1 - Ruane, A. C. A1 - Schmid, E. A1 - Schmitz, C. A1 - Stacke, T. A1 - Stehfest, E. A1 - Tang, Q. A1 - Wisser, D. A1 - Huber, Veronika A1 - Piontek, Franziska A1 - Warszawski, Lila A1 - Schewe, Jacob A1 - Lotze-Campen, Hermann A1 - Schellnhuber, Hans Joachim T1 - A framework for the cross-sectoral integration of multi-model impact projections BT - land use decisions under climate impacts uncertainties JF - Earth system dynamics N2 - Climate change and its impacts already pose considerable challenges for societies that will further increase with global warming (IPCC, 2014a, b). Uncertainties of the climatic response to greenhouse gas emissions include the potential passing of large-scale tipping points (e.g. Lenton et al., 2008; Levermann et al., 2012; Schellnhuber, 2010) and changes in extreme meteorological events (Field et al., 2012) with complex impacts on societies (Hallegatte et al., 2013). Thus climate change mitigation is considered a necessary societal response for avoiding uncontrollable impacts (Conference of the Parties, 2010). On the other hand, large-scale climate change mitigation itself implies fundamental changes in, for example, the global energy system. The associated challenges come on top of others that derive from equally important ethical imperatives like the fulfilment of increasing food demand that may draw on the same resources. For example, ensuring food security for a growing population may require an expansion of cropland, thereby reducing natural carbon sinks or the area available for bio-energy production. So far, available studies addressing this problem have relied on individual impact models, ignoring uncertainty in crop model and biome model projections. Here, we propose a probabilistic decision framework that allows for an evaluation of agricultural management and mitigation options in a multi-impact-model setting. Based on simulations generated within the Inter-Sectoral Impact Model Intercomparison Project (ISI-MIP), we outline how cross-sectorally consistent multi-model impact simulations could be used to generate the information required for robust decision making. Using an illustrative future land use pattern, we discuss the trade-off between potential gains in crop production and associated losses in natural carbon sinks in the new multiple crop-and biome-model setting. In addition, crop and water model simulations are combined to explore irrigation increases as one possible measure of agricultural intensification that could limit the expansion of cropland required in response to climate change and growing food demand. This example shows that current impact model uncertainties pose an important challenge to long-term mitigation planning and must not be ignored in long-term strategic decision making. Y1 - 2015 U6 - https://doi.org/10.5194/esd-6-447-2015 SN - 2190-4979 SN - 2190-4987 VL - 6 IS - 2 SP - 447 EP - 460 PB - Copernicus CY - Göttingen ER - TY - JOUR A1 - Schwarze, Thomas A1 - Riemer, Janine A1 - Eidner, Sascha A1 - Holdt, Hans-Jürgen T1 - A Highly K+-Selective Two-Photon Fluorescent Probe JF - Chemistry - a European journal N2 - A highly K+-selective two-photon fluorescent probe for the in vitro monitoring of physiological K+ levels in the range of 1-100 mM is reported. The two-photon excited fluorescence (TPEF) probe shows a fluorescence enhancement (FE) by a factor of about three in the presence of 160 mM K+, independently of one-photon (OP, 430 nm) or two-photon (TP, 860 nm) excitation and comparable K+-induced FEs in the presence of competitive Na+ ions. The estimated dissociation constant (K-d) values in Na+-free solutions (K-d(OP)=(28 +/- 5) mM and K-d(TP)=(36 +/- 6) mM) and in combined K+/Na+ solutions (K-d(OP)=(38 +/- 8) mM and K-d(TP)=(46 +/- 25) mM) reflecting the high K+/Na+ selectivity of the fluorescent probe. The TP absorption cross-section (sigma(2PA)) of the TPEF probe+160 mMK(+) is 26 GM at 860 nm. Therefore, the TPEF probe is a suitable tool for the in vitro determination of K+. KW - click chemistry KW - fluorescence KW - fluorescent probes KW - potassium KW - two-photon Y1 - 2015 U6 - https://doi.org/10.1002/chem.201501473 SN - 0947-6539 SN - 1521-3765 VL - 21 IS - 32 SP - 11306 EP - 11310 PB - Wiley-VCH CY - Weinheim ER - TY - CHAP A1 - Kiy, Alexander A1 - Geßner, Hendrik A1 - Lucke, Ulrike A1 - Grünewald, Franka T1 - A Hybrid and Modular Framework for Mobile Campus Applications T2 - i-com N2 - Mobile devices and associated applications (apps) are an indispensable part of daily life and provide access to important information anytime and anywhere. However, the availability of university-wide services in the mobile sector is still poor. If they exist they usually result from individual activities of students and teachers. Mobile applications can have an essential impact on the improvement of students’ self-organization as well as on the design and enhancement of specific learning scenarios, though. This article introduces a mobile campus app framework, which integrates central campus services and decentralized learning applications. An analysis of strengths and weaknesses of different approaches is presented to summarize and evaluate them in terms of requirements, development, maintenance and operation. The article discusses the underlying service-oriented architecture that allows transferring the campus app to other universities or institutions at reasonable cost. It concludes with a presentation of the results as well as ongoing discussions and future work KW - Mobile Campus Application KW - Hybrid App KW - Framework KW - Service-oriented Architecture Y1 - 2015 UR - http://www.degruyter.com/view/j/icom.2015.14.issue-1/icom-2015-0016/icom-2015-0016.xml U6 - https://doi.org/10.1515/icom-2015-0016 SN - 2196-6826 VL - 2015 IS - 14 SP - 63 EP - 73 PB - de Gruyter CY - Berlin ER - TY - JOUR A1 - Kneis, David T1 - A lightweight framework for rapid development of object-based hydrological model engines JF - Environmental modelling & software with environment data news N2 - Computer-based simulation models are frequently used in hydrological research and engineering but also in other fields of environmental sciences. New case studies often require existing model concepts to be adapted. Extensions may be necessary due to the peculiarities of the studied natural system or subtleties of anthropogenic control. In other cases, simplifications must be made in response to scarce data, incomplete knowledge, or restrictions set by the spatio-temporal scale of application. This paper introduces an open-source modeling framework called ECHSE designed to cope with the above-mentioned challenges. It provides a lightweight infrastructure for the rapid development of new, reusable simulation tools and, more importantly, the safe modification of existing formulations. ECHSE-based models treat the simulated system as a collection of interacting objects. Although feedbacks are generally supported, the majority of the objects' interactions is expected to be of the feed-forward type. Therefore, the ECHSE software is particularly useful in the context of hydrological catchment modeling. Conversely, it is unsuitable, e.g., for fully hydrodynamic simulations and groundwater flow modeling. The focus of the paper is put on a comprehensible outline of the ECHSE's fundamental concepts and limitations. For the purpose of illustration, a specific, ECHSE-based solution for hydrological catchment modeling is presented which has undergone testing in a number of river basins. (C) 2015 Elsevier Ltd. All rights reserved. KW - Modeling framework KW - Genetic model KW - Hydrology KW - ECHSE Y1 - 2015 U6 - https://doi.org/10.1016/j.envsoft.2015.02.009 SN - 1364-8152 SN - 1873-6726 VL - 68 SP - 110 EP - 121 PB - Elsevier CY - Oxford ER - TY - JOUR A1 - Dekker, Rianne A1 - Emilsson, Henrik A1 - Krieger, Bernhard A1 - Scholten, Peter T1 - A Local Dimension of Integration Policies? A Comparative Study of Berlin, Malmo, and Rotterdam JF - International migration review N2 - This study examines three theses on local integration policies by a qualitative comparative case study of integration policies in three cities in three different countries (Berlin, Malmo, and Rotterdam). We found little evidence of a congruent local dimension of integration policies. Local policies resemble their national policy frameworks fairly well in terms of policy approaches and domains. Our multi-level perspective shows that this is not the result of top-down hierarchical governance, but rather of a multilevel dynamic of two-way interaction. Local policy legacies and local politics matter and national policies are also influenced by local approaches of integration. Y1 - 2015 U6 - https://doi.org/10.1111/imre.12133 SN - 0197-9183 SN - 1747-7379 VL - 49 IS - 3 SP - 633 EP - 658 PB - Wiley-Blackwell CY - Hoboken ER - TY - INPR A1 - Petroczi, Andrea A1 - Backhouse, Susan H. A1 - Barkoukis, Vassilis A1 - Brand, Ralf A1 - Elbe, Anne-Marie A1 - Lazuras, Lambros A1 - Lucidi, Fabio T1 - A matter of mind-set in the interpretation of forensic application T2 - International journal of drug policy Y1 - 2015 U6 - https://doi.org/10.1016/j.drugpo.2015.06.007 SN - 0955-3959 SN - 1873-4758 VL - 26 IS - 11 SP - 1142 EP - 1143 PB - Elsevier CY - Amsterdam ER - TY - JOUR A1 - Kuhlmann, Sophie Merle A1 - Bürger, Arne A1 - Esser, Günter A1 - Hammerle, Florian T1 - A mindfulness-based stress prevention training for medical students (MediMind): study protocol for a randomized controlled trial JF - Trials N2 - Background: Medical training is very demanding and associated with a high prevalence of psychological distress. Compared to the general population, medical students are at a greater risk of developing a psychological disorder. Various attempts of stress management training in medical school have achieved positive results on minimizing psychological distress; however, there are often limitations. Therefore, the use of a rigorous scientific method is needed. The present study protocol describes a randomized controlled trial to examine the effectiveness of a specifically developed mindfulness-based stress prevention training for medical students that includes selected elements of cognitive behavioral strategies (MediMind). Methods/Design: This study protocol presents a prospective randomized controlled trial, involving four assessment time points: baseline, post-intervention, one-year follow-up and five-year follow-up. The aims include evaluating the effect on stress, coping, psychological morbidity and personality traits with validated measures. Participants are allocated randomly to one of three conditions: MediMind, Autogenic Training or control group. Eligible participants are medical or dental students in the second or eighth semester of a German university. They form a population of approximately 420 students in each academic term. A final total sample size of 126 (at five-year follow-up) is targeted. The trainings (MediMind and Autogenic Training) comprise five weekly sessions lasting 90 minutes each. MediMind will be offered to participants of the control group once the five-year follow-up is completed. The allotment is randomized with a stratified allocation ratio by course of studies, semester, and gender. After descriptive statistics have been evaluated, inferential statistical analysis will be carried out with a repeated measures ANOVA-design with interactions between time and group. Effect sizes will be calculated using partial.-square values. Discussion: Potential limitations of this study are voluntary participation and the risk of attrition, especially concerning participants that are allocated to the control group. Strengths are the study design, namely random allocation, follow-up assessment, the use of control groups and inclusion of participants at different stages of medical training with the possibility of differential analysis. Y1 - 2015 U6 - https://doi.org/10.1186/s13063-014-0533-9 SN - 1745-6215 VL - 16 PB - BioMed Central CY - London ER - TY - JOUR A1 - Knudsen, Mads Faurschou A1 - Egholm, David L. A1 - Jacobsen, Bo Holm A1 - Larsen, Nicolaj Krog A1 - Jansen, John D. A1 - Andersen, Jane Lund A1 - Linge, Henriette C. T1 - A multi-nuclide approach to constrain landscape evolution and past erosion rates in previously glaciated terrains JF - Quaternary geochronology : the international research and review journal on advances in quaternary dating techniques N2 - Cosmogenic nuclides are typically used to either constrain an exposure age, a burial age, or an erosion rate. Constraining the landscape history and past erosion rates in previously glaciated terrains is, however, notoriously difficult because it involves a large number of unknowns. The potential use of cosmogenic nuclides in landscapes with a complex history of exposure and erosion is therefore often quite limited. Here, we present a novel multi-nuclide approach to study the landscape evolution and past erosion rates in terrains with a complex exposure history, particularly focusing on regions that were repeatedly covered by glaciers or ice sheets during the Quaternary. The approach, based on the Markov Chain Monte Carlo (MCMC) technique, focuses on mapping the range of landscape histories that are consistent with a given set of measured cosmogenic nuclide concentrations. A fundamental assumption of the model approach is that the exposure history at the site/location can be divided into two distinct regimes: i) interglacial periods characterized by zero shielding due to overlying ice and a uniform interglacial erosion rate, and ii) glacial periods characterized by 100% shielding and a uniform glacial erosion rate. We incorporate the exposure history in the model framework by applying a threshold value to the global marine benthic delta O-18 record and include the threshold value as a free model parameter, hereby taking into account global changes in climate. However, any available information on the glacial-interglacial history at the sampling location, in particular the timing of the last deglaciation event, is readily incorporated in the model to constrain the inverse problem. Based on the MCMC technique, the model delineates the most likely exposure history, including the glacial and interglacial erosion rates, which, in turn, makes it possible to reconstruct an exhumation history at the site. We apply the model to two landscape scenarios based on synthetic data and two landscape scenarios based on paired Be-10/Al-26 data from West Greenland, which makes it possible to quantify the denudation rate at these locations. The model framework, which currently incorporates any combination of the following nuclides Be-10, Al-26, C-14, and Ne-21, is highly flexible and can be adapted to many different landscape settings. The model framework may also be used in combination with physics-based landscape evolution models to predict nuclide concentrations at different locations in the landscape. This may help validate the landscape models via comparison to measured nuclide concentrations or to devise new effective sampling strategies. (C) 2015 The Authors. Published by Elsevier B.V. KW - Cosmogenic-nuclide geochronology KW - Markov Chain Monte Carlo inversion KW - Glacial landscape history KW - Erosion rate reconstructions KW - Quaternary climate Y1 - 2015 U6 - https://doi.org/10.1016/j.quageo.2015.08.004 SN - 1871-1014 SN - 1878-0350 VL - 30 SP - 100 EP - 113 PB - Elsevier CY - Oxford ER - TY - JOUR A1 - Matis, Jochen Rene A1 - Schoenborn, Jan Boyke A1 - Saalfrank, Peter T1 - A multi-reference study of the byproduct formation for a ring-closed dithienylethene photoswitch JF - Physical chemistry, chemical physics : a journal of European Chemical Societies N2 - Photodriven molecular switches are sometimes hindered in their performance by forming byproducts which act as dead ends in sequences of switching cycles, leading to rapid fatigue effects. Understanding the reaction pathways to unwanted byproducts is a prerequisite for preventing them. This article presents a study of the photochemical reaction pathways for byproduct formation in the photochromic switch 1,2-bis-(3-thienyl)-ethene. Specifically, using single-and multi-reference methods the post-deexcitation reaction towards the byproduct in the electronic ground state S-0 when starting from the S-1-S-0 conical intersection (CoIn), is considered in detail. We find an unusual low-energy pathway, which offers the possibility for the formation of a dyotropic byproduct. Several high-energy pathways can be excluded with high probability. Y1 - 2015 U6 - https://doi.org/10.1039/c5cp00987a SN - 1463-9076 SN - 1463-9084 VL - 17 IS - 21 SP - 14088 EP - 14095 PB - Royal Society of Chemistry CY - Cambridge ER - TY - JOUR A1 - Matis, Jochen René A1 - Schönborn, Jan Boyke A1 - Saalfrank, Peter T1 - A multi-reference study of the byproduct formation for a ring-closed dithienylethene photoswitch JF - Physical chemistry, chemical physics : PCCP ; a journal of European Chemical Societies N2 - Photodriven molecular switches are sometimes hindered in their performance by forming byproducts which act as dead ends in sequences of switching cycles, leading to rapid fatigue effects. Understanding the reaction pathways to unwanted byproducts is a prerequisite for preventing them. This article presents a study of the photochemical reaction pathways for byproduct formation in the photochromic switch 1,2-bis-(3-thienyl)-ethene. Specifically, using single- and multi-reference methods the post-deexcitation reaction towards the byproduct in the electronic ground state S0 when starting from the S1–S0 conical intersection (CoIn), is considered in detail. We find an unusual low-energy pathway, which offers the possibility for the formation of a dyotropic byproduct. Several high-energy pathways can be excluded with high probability. Y1 - 2015 U6 - https://doi.org/10.1039/C5CP00987A SN - 1463-9076 SN - 1463-9084 IS - 17 SP - 14088 EP - 14095 PB - The Royal Society of Chemistry CY - Cambridge ER - TY - JOUR A1 - Roder, Phillip A1 - Hille, Carsten T1 - A Multifunctional Frontloading Approach for Repeated Recycling of a Pressure-Controlled AFM Micropipette JF - PLoS ONE N2 - Fluid force microscopy combines the positional accuracy and force sensitivity of an atomic force microscope (AFM) with nanofluidics via a microchanneled cantilever. However, adequate loading and cleaning procedures for such AFM micropipettes are required for various application situations. Here, a new frontloading procedure is described for an AFM micropipette functioning as a force- and pressure-controlled microscale liquid dispenser. This frontloading procedure seems especially attractive when using target substances featuring high costs or low available amounts. Here, the AFM micropipette could be filled from the tip side with liquid from a previously applied droplet with a volume of only a few μL using a short low-pressure pulse. The liquid-loaded AFM micropipettes could be then applied for experiments in air or liquid environments. AFM micropipette frontloading was evaluated with the well-known organic fluorescent dye rhodamine 6G and the AlexaFluor647-labeled antibody goat anti-rat IgG as an example of a larger biological compound. After micropipette usage, specific cleaning procedures were tested. Furthermore, a storage method is described, at which the AFM micropipettes could be stored for a few hours up to several days without drying out or clogging of the microchannel. In summary, the rapid, versatile and cost-efficient frontloading and cleaning procedure for the repeated usage of a single AFM micropipette is beneficial for various application situations from specific surface modifications through to local manipulation of living cells, and provides a simplified and faster handling for already known experiments with fluid force microscopy. Y1 - 2015 U6 - https://doi.org/10.1371/journal.pone.0144157 SN - 1932-6203 VL - 10 IS - 12 PB - Public Library of Science CY - Lawrence, Kan. ER - TY - JOUR A1 - Roder, Phillip A1 - Hille, Carsten T1 - A Multifunctional Frontloading Approach for Repeated Recycling of a Pressure-Controlled AFM Micropipette JF - PLoS one N2 - Fluid force microscopy combines the positional accuracy and force sensitivity of an atomic force microscope (AFM) with nanofluidics via a microchanneled cantilever. However, adequate loading and cleaning procedures for such AFM micropipettes are required for various application situations. Here, a new frontloading procedure is described for an AFM micropipette functioning as a force-and pressure-controlled microscale liquid dispenser. This frontloading procedure seems especially attractive when using target substances featuring high costs or low available amounts. Here, the AFM micropipette could be filled from the tip side with liquid from a previously applied droplet with a volume of only a few mu L using a short low-pressure pulse. The liquid-loaded AFM micropipettes could be then applied for experiments in air or liquid environments. AFM micropipette frontloading was evaluated with the well-known organic fluorescent dye rhodamine 6G and the AlexaFluor647-labeled antibody goat anti-rat IgG as an example of a larger biological compound. After micropipette usage, specific cleaning procedures were tested. Furthermore, a storage method is described, at which the AFM micropipettes could be stored for a few hours up to several days without drying out or clogging of the microchannel. In summary, the rapid, versatile and cost-efficient frontloading and cleaning procedure for the repeated usage of a single AFM micropipette is beneficial for various application situations from specific surface modifications through to local manipulation of living cells, and provides a simplified and faster handling for already known experiments with fluid force microscopy. Y1 - 2015 U6 - https://doi.org/10.1371/journal.pone.0144157 SN - 1932-6203 VL - 10 IS - 12 PB - PLoS CY - San Fransisco ER - TY - JOUR A1 - Weilbacher, Peter Michael A1 - Monreal-Ibero, Ana A1 - Kollatschny, Wolfram A1 - Ginsburg, Adam A1 - McLeod, Anna F. A1 - Kamann, Sebastian A1 - Sandin, Christer A1 - Palsa, Ralf A1 - Wisotzki, Lutz A1 - Bacon, Roland A1 - Selman, Fernando A1 - Brinchmann, Jarle A1 - Caruana, Joseph A1 - Kelz, Andreas A1 - Martinsson, Thomas A1 - Pecontal-Rousset, Arlette A1 - Richard, Johan A1 - Wendt, Martin T1 - A MUSE map of the central Orion Nebula (M 42) JF - Astronomy and astrophysics : an international weekly journal N2 - We present a new integral field spectroscopic dataset of the central part of the Orion Nebula (M 42), observed with the MUSE instrument at the ESO VLT. We reduced the data with the public MUSE pipeline. The output products are two FITS cubes with a spatial size of similar to 5'9 x 4'9 (corresponding to similar to 0.76 x 0.63 pc(2)) and a contiguous wavelength coverage of 4595 ... 9366 angstrom, spatially sampled at 0 ''.2. We provide two versions with a sampling of 1.25 angstrom and 0.85 angstrom in dispersion direction. Together with variance cubes these files have a size of 75 and 110 GiB on disk. They are the largest integral field mosaics to date in terms of information content. We make them available for use in the community. To validate this dataset, we compare world coordinates, reconstructed magnitudes, velocities, and absolute and relative emission line fluxes to the literature values and find excellent agreement. We derive a 2D map of extinction and present de-reddened flux maps of several individual emission lines and of diagnostic line ratios. We estimate physical properties of the Orion Nebula, using the emission line ratios [N II] and [S III] (for the electron temperature T-e) and [S II] and [Cl III] (for the electron density N-e), and show 2D images of the velocity measured from several bright emission lines. KW - H II regions KW - ISM: individual objects: M 42 KW - open clusters and associations: individual: Trapezium cluster Y1 - 2015 U6 - https://doi.org/10.1051/0004-6361/201526529 SN - 1432-0746 VL - 582 PB - EDP Sciences CY - Les Ulis ER - TY - JOUR A1 - Pape, Simon A1 - Wessig, Pablo A1 - Brunner, Heiko T1 - A new and environmentally benign synthesis of aroylguanidines using iron trichloride JF - RSC Advances N2 - A new synthetic approach for the guanylation of aroylthioureas using iron trichloride is presented. Our synthetic method distinguishes itself by benign reaction conditions, low costs and a broad product spectrum. The scope of the reaction and calorimetric studies are described. Y1 - 2015 U6 - https://doi.org/10.1039/c5ra20869f SN - 2046-2069 VL - 5 IS - 123 SP - 101408 EP - 101411 PB - Royal Society of Chemistry CY - Cambridge ER - TY - JOUR A1 - Ionescu, Danny A1 - Bizic-Ionescu, Mina A1 - Khalili, Arzhang A1 - Malekmohammadi, Reza A1 - Morad, Reza Mohammad A1 - de Beer, Dirk A1 - Grossart, Hans-Peter T1 - A new tool for long-term studies of POM-bacteria interactions: overcoming the century-old Bottle Effect JF - Scientific reports N2 - Downward fluxes of particulate organic matter (POM) are the major process for sequestering atmospheric CO2 into aquatic sediments for thousands of years. Budget calculations of the biological carbon pump are heavily based on the ratio between carbon export (sedimentation) and remineralization (release to the atmosphere). Current methodologies determine microbial dynamics on POM using closed vessels, which are strongly biased towards heterotrophy due to rapidly changing water chemistry (Bottle Effect). We developed a flow-through rolling tank for long term studies that continuously maintains POM at near in-situ conditions. There, bacterial communities resembled in-situ communities and greatly differed from those in the closed systems. The active particle-associated community in the flow-through system was stable for days, contrary to hours previously reported for closed incubations. In contrast to enhanced respiration rates, the decrease in photosynthetic rates on particles throughout the incubation was much slower in our system than in traditional ones. These results call for reevaluating experimentally-derived carbon fluxes estimated using traditional methods. Y1 - 2015 U6 - https://doi.org/10.1038/srep14706 SN - 2045-2322 VL - 5 PB - Nature Publ. Group CY - London ER - TY - JOUR A1 - Bruttel, Lisa Verena A1 - Friehe, Tim T1 - A note on making humans randomize JF - Journal of behavioral and experimental economics N2 - This note presents results from an experiment studying a two person 4 4 pure coordination game. We explore different strategy labels in an attempt to implement the mixed strategy equilibrium that selects all four strategies with equal probability. Such strategy labels must be free from salient properties that might be used by participants to coordinate. Testing 23 different sets of strategy labels, we identify two sets that produce a distribution of subjects' choices which approximate the uniform distribution quite well. Our results are relevant for studies intending to compare the behavior of subjects who play against a random mechanism with that of participants who play against human counterparts. KW - Coordination game KW - Experiment KW - Mixed strategy Y1 - 2015 U6 - https://doi.org/10.1016/j.socec.2015.06.008 SN - 2214-8043 SN - 2214-8051 VL - 58 SP - 40 EP - 45 PB - Elsevier CY - New York ER - TY - JOUR A1 - van der Valk, Ralf J. P. A1 - Kreiner-Moller, Eskil A1 - Kooijman, Marjolein N. A1 - Guxens, Monica A1 - Stergiakouli, Evangelia A1 - Saaf, Annika A1 - Bradfield, Jonathan P. A1 - Geller, Frank A1 - Hayes, M. Geoffrey A1 - Cousminer, Diana L. A1 - Koerner, Antje A1 - Thiering, Elisabeth A1 - Curtin, John A. A1 - Myhre, Ronny A1 - Huikari, Ville A1 - Joro, Raimo A1 - Kerkhof, Marjan A1 - Warrington, Nicole M. A1 - Pitkanen, Niina A1 - Ntalla, Ioanna A1 - Horikoshi, Momoko A1 - Veijola, Riitta A1 - Freathy, Rachel M. A1 - Teo, Yik-Ying A1 - Barton, Sheila J. A1 - Evans, David M. A1 - Kemp, John P. A1 - St Pourcain, Beate A1 - Ring, Susan M. A1 - Smith, George Davey A1 - Bergstrom, Anna A1 - Kull, Inger A1 - Hakonarson, Hakon A1 - Mentch, Frank D. A1 - Bisgaard, Hans A1 - Chawes, Bo Lund Krogsgaard A1 - Stokholm, Jakob A1 - Waage, Johannes A1 - Eriksen, Patrick A1 - Sevelsted, Astrid A1 - Melbye, Mads A1 - van Duijn, Cornelia M. A1 - Medina-Gomez, Carolina A1 - Hofman, Albert A1 - de Jongste, Johan C. A1 - Taal, H. Rob A1 - Uitterlinden, Andre G. A1 - Armstrong, Loren L. A1 - Eriksson, Johan A1 - Palotie, Aarno A1 - Bustamante, Mariona A1 - Estivill, Xavier A1 - Gonzalez, Juan R. A1 - Llop, Sabrina A1 - Kiess, Wieland A1 - Mahajan, Anubha A1 - Flexeder, Claudia A1 - Tiesler, Carla M. T. A1 - Murray, Clare S. A1 - Simpson, Angela A1 - Magnus, Per A1 - Sengpiel, Verena A1 - Hartikainen, Anna-Liisa A1 - Keinanen-Kiukaanniemi, Sirkka A1 - Lewin, Alexandra A1 - Alves, Alexessander Da Silva Couto A1 - Blakemore, Alexandra I. F. A1 - Buxton, Jessica L. A1 - Kaakinen, Marika A1 - Rodriguez, Alina A1 - Sebert, Sylvain A1 - Vaarasmaki, Marja A1 - Lakka, Timo A1 - Lindi, Virpi A1 - Gehring, Ulrike A1 - Postma, Dirkje S. A1 - Ang, Wei A1 - Newnham, John P. A1 - Lyytikainen, Leo-Pekka A1 - Pahkala, Katja A1 - Raitakari, Olli T. A1 - Panoutsopoulou, Kalliope A1 - Zeggini, Eleftheria A1 - Boomsma, Dorret I. A1 - Groen-Blokhuis, Maria A1 - Ilonen, Jorma A1 - Franke, Lude A1 - Hirschhorn, Joel N. A1 - Pers, Tune H. A1 - Liang, Liming A1 - Huang, Jinyan A1 - Hocher, Berthold A1 - Knip, Mikael A1 - Saw, Seang-Mei A1 - Holloway, John W. A1 - Melen, Erik A1 - Grant, Struan F. A. A1 - Feenstra, Bjarke A1 - Lowe, William L. A1 - Widen, Elisabeth A1 - Sergeyev, Elena A1 - Grallert, Harald A1 - Custovic, Adnan A1 - Jacobsson, Bo A1 - Jarvelin, Marjo-Riitta A1 - Atalay, Mustafa A1 - Koppelman, Gerard H. A1 - Pennell, Craig E. A1 - Niinikoski, Harri A1 - Dedoussis, George V. A1 - Mccarthy, Mark I. A1 - Frayling, Timothy M. A1 - Sunyer, Jordi A1 - Timpson, Nicholas J. A1 - Rivadeneira, Fernando A1 - Bonnelykke, Klaus A1 - Jaddoe, Vincent W. V. T1 - A novel common variant in DCST2 is associated with length in early life and height in adulthood JF - Human molecular genetics N2 - Common genetic variants have been identified for adult height, but not much is known about the genetics of skeletal growth in early life. To identify common genetic variants that influence fetal skeletal growth, we meta-analyzed 22 genome-wide association studies (Stage 1; N = 28 459). We identified seven independent top single nucleotide polymorphisms (SNPs) (P < 1 x 10(-6)) for birth length, of which three were novel and four were in or near loci known to be associated with adult height (LCORL, PTCH1, GPR126 and HMGA2). The three novel SNPs were followed-up in nine replication studies (Stage 2; N = 11 995), with rs905938 in DC-STAMP domain containing 2 (DCST2) genome-wide significantly associated with birth length in a joint analysis (Stages 1 + 2; beta = 0.046, SE = 0.008, P = 2.46 x 10(-8), explained variance = 0.05%). Rs905938 was also associated with infant length (N = 28 228; P = 5.54 x 10(-4)) and adult height (N = 127 513; P = 1.45 x 10(-5)). DCST2 is a DC-STAMP-like protein family member and DC-STAMP is an osteoclast cell-fusion regulator. Polygenic scores based on 180 SNPs previously associated with human adult stature explained 0.13% of variance in birth length. The same SNPs explained 2.95% of the variance of infant length. Of the 180 known adult height loci, 11 were genome-wide significantly associated with infant length (SF3B4, LCORL, SPAG17, C6orf173, PTCH1, GDF5, ZNFX1, HHIP, ACAN, HLA locus and HMGA2). This study highlights that common variation in DCST2 influences variation in early growth and adult height. Y1 - 2015 U6 - https://doi.org/10.1093/hmg/ddu510 SN - 0964-6906 SN - 1460-2083 VL - 24 IS - 4 SP - 1155 EP - 1168 PB - Oxford Univ. Press CY - Oxford ER - TY - JOUR A1 - Lehr, C. A1 - Pöschke, Franziska A1 - Lewandowski, Jörg A1 - Lischeid, Gunnar T1 - A novel method to evaluate the effect of a stream restoration on the spatial pattern of hydraulic connection of stream and groundwater JF - Journal of hydrology N2 - Stream restoration aims at an enhancement of ecological habitats, an increase of water retention within a landscape and sometimes even at an improvement of biogeochemical functions of lotic ecosystems. For the latter, good exchange between groundwater and stream water is often considered to be of major importance. In this study hydraulic connectivity between river and aquifer was investigated for a four years period, covering the restoration of an old oxbow after the second year. The oxbow became reconnected to the stream and the clogging layer in the oxbow was excavated. We expected increasing hydraulic connectivity between oxbow and aquifer after restoration of the stream, and decreasing hydraulic connectivity for the former shortcut due to increased clogging. To test that hypothesis, the spatial and temporal characteristics of the coupled groundwater-stream water system before and after the restoration were analysed by principal component analyses of time series of groundwater heads and stream water levels. The first component depicted between 53% and 70% of the total variance in the dataset for the different years. It captured the propagation of the pressure signal induced by stream water level fluctuations throughout the adjacent aquifer. Thus it could be used as a measure of hydraulic connectivity between stream and aquifer. During the first year, the impact of stream water level fluctuations decreased with distance from the regulated river (shortcut), whereas the hydraulic connection of the oxbow to the adjacent aquifer was very low. After restoration of the stream we observed a slight but not significant increase of hydraulic connectivity in the oxbow in the second year after restoration, but no change for the former shortcut. There is some evidence that the pattern of hydraulic connectivity at the study site is by far more determined by the natural heterogeneity of hydraulic conductivities of the floodplain sediments and the initial construction of the shortcut rather than by the clogging layer in the oxbow. (C) 2015 The Authors. Published by Elsevier B.V. KW - Groundwater-stream water interactions KW - Principal component analysis KW - Signal propagation KW - Hydraulic connectivity KW - Clogging KW - Riparian zone Y1 - 2015 U6 - https://doi.org/10.1016/j.jhydrol.2015.04.075 SN - 0022-1694 SN - 1879-2707 VL - 527 SP - 394 EP - 401 PB - Elsevier CY - Amsterdam ER - TY - CHAP A1 - Haralampiev, Ivan A1 - Mertens, Monique A1 - Schwarzer, Roland A1 - Herrmann, Andreas A1 - Volkmer, Rudolf A1 - Wessig, Pablo A1 - Müller, Peter T1 - A palmitic acid functionalized with a maleimide group is used to recruit SH-containing peptides to lipid and biological membranes T2 - The FEBS journal Y1 - 2015 SN - 1742-464X SN - 1742-4658 VL - 282 SP - 204 EP - 204 PB - Wiley-Blackwell CY - Hoboken ER - TY - JOUR A1 - Liang, Feng A1 - Liu, Yunzhen A1 - Liu, Hai A1 - Ma, Shilong A1 - Schnor, Bettina T1 - A Parallel Job Execution Time Estimation Approach Based on User Submission Patterns within Computational Grids JF - International journal of parallel programming N2 - Scheduling performance in computational grid can potentially benefit a lot from accurate execution time estimation for parallel jobs. Most existing approaches for the parallel job execution time estimation, however, require ample past job traces and the explicit correlations between the job execution time and the outer layout parameters such as the consumed processor numbers, the user-estimated execution time and the job ID, which are hard to obtain or reveal. This paper presents and evaluates a novel execution time estimation approach for parallel jobs, the user-behavior clustering for execution time estimation, which can give more accurate execution time estimation for parallel jobs through exploring the job similarity and revealing the user submission patterns. Experiment results show that compared to the state-of-art algorithms, our approach can improve the accuracy of the job execution time estimation up to 5.6 %, meanwhile the time that our approach spends on calculation can be reduced up to 3.8 %. KW - User submission pattern KW - Parallel job execution time estimation KW - Computational grid Y1 - 2015 U6 - https://doi.org/10.1007/s10766-013-0294-1 SN - 0885-7458 SN - 1573-7640 VL - 43 IS - 3 SP - 440 EP - 454 PB - Springer CY - New York ER - TY - JOUR A1 - Contin, Andrea A1 - Frasca, Stefano A1 - Vivekananthan, Jeevanthi A1 - Leimkühler, Silke A1 - Wollenberger, Ursula A1 - Plumere, Nicolas A1 - Schuhmann, Wolfgang T1 - A pH Responsive Redox Hydrogel for Electrochemical Detection of Redox Silent Biocatalytic Processes. Control of Hydrogel Solvation JF - Electroanalysis : an international journal devoted to fundamental and practical aspects of electroanalysis N2 - The control of bioelectrocatalytic processes by external stimuli for the indirect detection of non-redox active species was achieved using an esterase and a redox enzyme both integrated within a redox hydrogel. The poly( vinyl) imidazole Os(bpy)(2)Cl hydrogel displays pH-responsive properties. The esterase catalysed reaction leads to a local pH decrease causing protonation of imidazole moieties thus increasing hydrogel solvation and mobility of the tethered Os-complexes. This is the key step to enable improved electron transfer between an aldehyde oxidoreductase and the polymer-bound Os-complexes. The off-on switch is further integrated in a biofuel cell system for self-powered signal generation. KW - pH responsive hydrogel KW - External stimuli KW - Biofuel cell KW - Self-powered biosensor KW - Solvation Y1 - 2015 U6 - https://doi.org/10.1002/elan.201400621 SN - 1040-0397 SN - 1521-4109 VL - 27 IS - 4 SP - 938 EP - 944 PB - Wiley-VCH CY - Weinheim ER - TY - JOUR A1 - Rolinski, Susanne A1 - Rammig, A. A1 - Walz, Ariane A1 - von Bloh, Werner A1 - van Oijen, M. A1 - Thonicke, Kirsten T1 - A probabilistic risk assessment for the vulnerability of the European carbon cycle to weather extremes: the ecosystem perspective JF - Biogeosciences N2 - Extreme weather events are likely to occur more often under climate change and the resulting effects on ecosystems could lead to a further acceleration of climate change. But not all extreme weather events lead to extreme ecosystem response. Here, we focus on hazardous ecosystem behaviour and identify coinciding weather conditions. We use a simple probabilistic risk assessment based on time series of ecosystem behaviour and climate conditions. Given the risk assessment terminology, vulnerability and risk for the previously defined hazard are estimated on the basis of observed hazardous ecosystem behaviour. We apply this approach to extreme responses of terrestrial ecosystems to drought, defining the hazard as a negative net biome productivity over a 12-month period. We show an application for two selected sites using data for 1981-2010 and then apply the method to the pan-European scale for the same period, based on numerical modelling results (LPJmL for ecosystem behaviour; ERA-Interim data for climate). Our site-specific results demonstrate the applicability of the proposed method, using the SPEI to describe the climate condition. The site in Spain provides an example of vulnerability to drought because the expected value of the SPEI is 0.4 lower for hazardous than for non-hazardous ecosystem behaviour. In northern Germany, on the contrary, the site is not vulnerable to drought because the SPEI expectation values imply wetter conditions in the hazard case than in the non-hazard case. At the pan-European scale, ecosystem vulnerability to drought is calculated in the Mediterranean and temperate region, whereas Scandinavian ecosystems are vulnerable under conditions without water shortages. These first model- based applications indicate the conceptual advantages of the proposed method by focusing on the identification of critical weather conditions for which we observe hazardous ecosystem behaviour in the analysed data set. Application of the method to empirical time series and to future climate would be important next steps to test the approach. Y1 - 2015 U6 - https://doi.org/10.5194/bg-12-1813-2015 SN - 1726-4170 SN - 1726-4189 VL - 12 IS - 6 SP - 1813 EP - 1831 PB - Copernicus CY - Göttingen ER -