TY - JOUR A1 - Böhm, Verónica Julia A1 - Hennemann, Anja T1 - The Spanish imperfecto as a construal form for the conceptualization of state of affairs in journalistic texts N2 - This study adopts a cognitive approach to the analysis of the use of the Spanish imperfecto as a construal form for the conceptualization of state of affairs in certain journalistic texts. In doing so, the main focus of the study is to investigate cognitive processes like modalization and subjectivization, which are related to the speaker’s standpoint and to his subjective, not grammatically motivated, decision to use the imperfective instead of the perfective form. By the help of the corpus programmes GlossaNet and CREA (corpus of the Real Academia Española) we analyze the imperfective use of some Spanish verbs, which are semantically perfective in nature so that the normative use would require a perfective form. In other words, we investigate how the speaker/journalist construes a reality or situation to be expressed by means of the imperfecto and show that this use of the imperfect is typical for journalistic discourse. KW - cognitive grammar KW - Spanish imperfect KW - modalization KW - subjectivization Y1 - 2018 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-416094 ER - TY - GEN A1 - Brendel, Heiko T1 - ‘Hasty observations’? BT - Geographical field research and intercultural encounters in the Austro- Hungarian occupied Western Balkans, 1916–1918 T2 - Postprints der Universität Potsdam Philosophische Reihe N2 - This article examines geographical field research in Albania and Montenegro under Austro-Hungarian occupation, which lasted from 1916 to 1918. It focusses on one of the most important German-speaking geographers of the early 20 th century, Eugen Oberhummer (1859–1944), a pupil of Friedrich Ratzel, the founder of German geo-politics. In 1917 and 1918, Oberhummer went on two expeditions to Montenegro and Albania during the First World War. He already had travelled in four continents and vaguely knew the Western Balkans from an expedition in 1907. It will be argued that the actual situation in Albania and Montenegro did not alter, but did rather reinforce Oberhummer’s attitudes and opinions on the ‘other’ he encountered. Thus, the two war expeditions – Oberhummer primarily met high-ranking Austro-Hungarian officials and only few locals – confirmed his expectations basing on his ‘Ratzelian’ theoretical conceptions. It will further be argued that – in contrast to the much younger and less experienced ‘scholars-at-arms’ of the expedition of 1916 – war and violence were of secondary relevance for the well-travelled and renowned professor of geography in his late 50s. Neither in Oberhummer’s articles nor in his diaries the war and the occupation of Albania and Montenegro made up an important part. In Oberhummer’s ‘Ratzelian’ view, humans could not change or over-come the basic features of geography, as humans were clearly subordinated to the elemental forces of geography. People, over generations, adapted to geography, not the other way round. The on-going First World War was an opportunity for Oberhummer to travel to Albania and Montenegro, but the guerrilla warfare in large parts of Montenegro, the violence against the civilian population, and the fighting at the Albanian front were of secondary relevance and interest for him. Nevertheless, what Oberhummer observed offers great insights into the Austro-Hungarian occupation of Montenegro and Albania from the perspective of a renowned and – given the general circumstances – pleasantly relaxed Ratzelian geographer at the height of his academic career. T3 - Zweitveröffentlichungen der Universität Potsdam : Philosophische Reihe - 166 KW - Albania KW - Montenegro KW - Austro-Hungarian occupation 1916–1918 KW - geographical field research KW - Eugen Oberhummer KW - Friedrich Ratzel Y1 - 2019 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-435000 SN - 1866-8380 IS - 166 SP - 184 EP - 208 ER - TY - GEN A1 - Kurz, Verena A1 - Orland, Andreas A1 - Posadzy, Kinga T1 - Fairness versus efficiency BT - how procedural fairness concerns affect coordination T2 - Postprints der Universität Potsdam Wirtschafts- und Sozialwissenschaftliche Reihe N2 - We investigate in a laboratory experiment whether procedural fairness concerns affect how well individuals are able to solve a coordination problem in a two-player Volunteer's Dilemma. Subjects receive external action recommendations, either to volunteer or to abstain from it, in order to facilitate coordination and improve efficiency. We manipulate the fairness of the recommendation procedure by varying the probabilities of receiving the disadvantageous recommendation to volunteer between players. We find evidence that while recommendations improve overall efficiency regardless of their implications for expected payoffs, there are behavioural asymmetries depending on the recommendation: advantageous recommendations are followed less frequently than disadvantageous ones and beliefs about others' actions are more pessimistic in the treatment with recommendations inducing unequal expected payoffs. T3 - Zweitveröffentlichungen der Universität Potsdam : Wirtschafts- und Sozialwissenschaftliche Reihe - 117 KW - coordination KW - correlated equilibrium KW - recommendations KW - procedural fairness KW - volunteer’s dilemma KW - experiment Y1 - 2019 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-432611 SN - 1867-5808 IS - 117 SP - 601 EP - 626 ER - TY - GEN A1 - Fuchs, Matthias A1 - Grosse, Guido A1 - Strauss, Jens A1 - Günther, Frank A1 - Grigoriev, Mikhail N. A1 - Maximov, Georgy M. A1 - Hugelius, Gustaf T1 - Carbon and nitrogen pools in thermokarst-affected permafrost landscapes in Arctic Siberia T2 - Postprints der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe N2 - Ice-rich yedoma-dominated landscapes store con- siderable amounts of organic carbon (C) and nitrogen (N) and are vulnerable to degradation under climate warming. We investigate the C and N pools in two thermokarst-affected yedoma landscapes – on Sobo-Sise Island and on Bykovsky Peninsula in the north of eastern Siberia. Soil cores up to 3 m depth were collected along geomorphic gradients and anal- ysed for organic C and N contents. A high vertical sampling density in the profiles allowed the calculation of C and N stocks for short soil column intervals and enhanced under- standing of within-core parameter variability. Profile-level C and N stocks were scaled to the landscape level based on landform classifications from 5 m resolution, multispectral RapidEye satellite imagery. Mean landscape C and N storage in the first metre of soil for Sobo-Sise Island is estimated to be 20.2 kg C m −2 and 1.8 kg N m −2 and for Bykovsky Penin- sula 25.9 kg C m −2 and 2.2 kg N m −2 . Radiocarbon dating demonstrates the Holocene age of thermokarst basin de- posits but also suggests the presence of thick Holocene- age cover layers which can reach up to 2 m on top of in- tact yedoma landforms. Reconstructed sedimentation rates of 0.10–0.57 mm yr −1 suggest sustained mineral soil accu- mulation across all investigated landforms. Both yedoma and thermokarst landforms are characterized by limited accumu- lation of organic soil layers (peat). We further estimate that an active layer deepening of about 100 cm will increase organic C availability in a sea- sonally thawed state in the two study areas by ∼ 5.8 Tg (13.2 kg C m −2 ). Our study demonstrates the importance of increasing the number of C and N storage inventories in ice- rich yedoma and thermokarst environments in order to ac- count for high variability of permafrost and thermokarst en- vironments in pan-permafrost soil C and N pool estimates. T3 - Zweitveröffentlichungen der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe - 654 KW - soil organic-carbon KW - Lena River Delta KW - ice-rich permafrost KW - thaw-lake basins KW - climate-change KW - northern Siberia KW - Late Quaternary KW - periglacial landscape KW - Tundra ecosystem KW - Yedoma region Y1 - 2019 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-418026 SN - 1866-8372 VL - 15 IS - 654 ER - TY - THES A1 - Kraft, Frederik T1 - Be Creative, Now! T1 - Sei jetzt kreativ! BT - The Paradox of Freedom in Organizations BT - Das Paradoxon der Freiheit in Organisationen N2 - Purpose – This thesis set out to explore, describe, and evaluate the reality behind the rhetoric of freedom and control in the context of creativity. The overarching subject is concerned with the relationship between creativity, freedom, and control, considering freedom is also seen as an element of control to manage creativity. Design/methodology/approach – In-depth qualitative data gathered from at two innovative start-ups. Two ethnographic studies were conducted. The data are based on participatory observations, interviews, and secondary sources, each of which included a three months field study and a total of 41 interviews from both organizations. Findings – The thesis provides explanations for the practice of freedom and the control of creativity within organizations and expands the existing theory of neo-normative control. The findings indicate that organizations use complex control systems that allow a high degree of freedom that paradoxically leads to more control. Freedom is a cover of control, which in turn leads to creativity. Covert control even results in the responsibility to be creative outside working hours. Practical implications – Organizations, which rely on creativity might use the results of this thesis. Positive workplace control of creativity provides both freedom and structure for creative work. While freedom leads to organizational members being more motivated and committing themselves more strongly to their and the organization’s goals, and a specific structure also helps to provide the requirements for creativity. Originality/value – The thesis provides an insight into an approach to workplace control, which has mostly neglected in creativity research and proposes a modified concept of neo-normative control. It serves to provide a further understanding of freedom for creativity and to challenge the liberal claims of new control forms. N2 - Relevanz – Diese Dissertation hat das Ziel zu erforschen, zu beschreiben und zu bewerten, wie Freiheit als Kontrollform für Kreativität in Organisationen instrumentalisiert werden kann. Die Arbeit untersucht das Verhältnis von Kreativität, Freiheit und Kontrolle. Dabei wird Freiheit auch als eine Form der Kontrolle zur Einflussnahme auf Kreativität gesehen. Methode – Ausführliche qualitative Daten wurden in jeweils dreimonatigen Feldstudien, in zwei innovativen Start-ups erhoben. Für die beiden ethnographischen Studien wurden insgesamt 41 Interviews geführt. Ergänzt wurden die Daten aus den Interviews durch Feldbeobachtungen und Sekundärquellen. Resultate – Die Dissertation liefert Erklärungen für die Instrumentalisierung von Freiheit um Kreativität zu kontrollieren und erweitert die bestehende Theorie der neo-normativen Kontrolle. Die Ergebnisse zeigen, dass Organisationen komplexe Kontrollsysteme einsetzen, die einen hohen Freiheitsgrad erlauben, der paradoxerweise zu mehr Kontrolle führt. Freiheit wird dadurch zu einer verdeckten Kontrolle, die wiederum zu mehr Kreativität führt. Diese verdeckte Kontrolle kann sogar zu der Verantwortung führen, außerhalb der Arbeitszeit kreativ sein zu müssen. Implikationen – Die Ergebnisse sind relevant für Organisationen die Kreativität brauchen. Eine kreativitätsunterstützende Kontrolle bietet sowohl Freiheit, als auch Struktur. Die Freiheit führt dazu, dass die Mitglieder der Organisation motivierter sind und sich stärker für ihre und die Ziele der Organisation engagieren. Eine spezifische Struktur hilft, die Voraussetzungen für Kreativität zu schaffen und die Mitarbeiter zu entlasten, indem ihre Arbeitszeit reguliert wird. Originalität – Die Dissertation gibt einen neuartigen Einblick in die Arbeitsplatzkontrolle, die in der Kreativitätsforschung meist vernachlässigt wurde und ein modifiziertes Konzept der neo-normativen Kontrolle vorschlägt. Die Forschungsarbeit dient dazu, ein breiteres Verständnis für die Wechselbeziehung von Freiheit und Kreativität zu schaffen und stellt gleichzeitig die liberalen Ansprüche neuer Kontrollformen in Frage. KW - Kreativität KW - Freiheit KW - Neo-normative Kontrolle KW - Organisationen KW - creativity KW - freedom KW - neo-normative control KW - organization Y1 - 2018 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-414009 ER - TY - GEN A1 - Schnitzler, Joseph G. A1 - Pinzone, Marianna A1 - Autenrieth, Marijke A1 - van Neer, Abbo A1 - IJsseldijk, Lonneke L. A1 - Barber, Jonathan L. A1 - Deaville, Rob A1 - Jepson, Paul A1 - Brownlow, Andrew A1 - Schaffeld, Tobias A1 - Thomé, Jean-Pierre A1 - Tiedemann, Ralph A1 - Das, Krishna A1 - Siebert, Ursula T1 - Inter-individual differences in contamination profiles as tracer of social group association in stranded sperm whales T2 - Postprints der Universität Potsdam Mathematisch-Naturwissenschaftliche Reihe N2 - Ecological and physiological factors lead to different contamination patterns in individual marine mammals. The objective of the present study was to assess whether variations in contamination profiles are indicative of social structures of young male sperm whales as they might reflect a variation in feeding preferences and/or in utilized feeding grounds. We used a total of 61 variables associated with organic compounds and trace element concentrations measured in muscle, liver, kidney and blubber gained from 24 sperm whales that stranded in the North Sea in January and February 2016. Combining contaminant and genetic data, there is evidence for at least two cohorts with different origin among these stranded sperm whales; one from the Canary Island region and one from the northern part of the Atlantic. While genetic data unravel relatedness and kinship, contamination data integrate over areas, where animals occured during their lifetime. Especially in long-lived animals with a large migratory potential, as sperm whales, contamination data may carry highly relevant information about aggregation through time and space. T3 - Zweitveröffentlichungen der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe - 692 KW - porpoises phococena-phococena KW - North-sea KW - physeter-macrocephalus KW - Galapagos-Islands KW - harbor porpoises KW - cetacean strandings KW - aggregations KW - pollutants KW - behavior KW - mammals Y1 - 2019 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-426525 SN - 1866-8372 IS - 692 ER - TY - GEN A1 - Scherer, Ulrike A1 - Tiedemann, Ralph A1 - Schlupp, Ingo T1 - Male size, not female preferences influence female reproductive success in a poeciliid fish (Poecilia latipinna) BT - a combined behavioural/genetic approach T2 - BMC Research Notes N2 - Objective We investigated the potential role of indirect benefits for female mate preferences in a highly promiscuous species of live-bearing fishes, the sailfin molly Poecilia latipinna using an integrative approach that combines methods from animal behavior, life-history evolution, and genetics. Males of this species solely contribute sperm for reproduction, and consequently females do not receive any direct benefits. Despite this, females typically show clear mate preferences. It has been suggested that females can increase their reproductive success through indirect benefits from choosing males of higher quality. Results Although preferences for large body size have been recorded as an honest signal for genetic quality, this particular study resulted in female preference being unaffected by male body size. Nonetheless, larger males did sire more offspring, but with no effect on offspring quality. This study presents a methodical innovation by combining preference testing with life history measurements—such as the determination of the dry weight of fish embryos—and paternity analyses on single fish embryos. T3 - Zweitveröffentlichungen der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe - 468 KW - Fitness KW - Life history KW - Mate choice KW - Microsatellite analysis KW - Offspring weight KW - Paternity analysis KW - Sailfin molly KW - Sexual selection Y1 - 2018 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-417471 ER - TY - GEN A1 - Schedina, Ina Maria A1 - Groth, Detlef A1 - Schlupp, Ingo A1 - Tiedemann, Ralph T1 - The gonadal transcriptome of the unisexual Amazon molly Poecilia formosa in comparison to its sexual ancestors, Poecilia mexicana and Poecilia latipinna N2 - Abstract Background The unisexual Amazon molly (Poecilia formosa) originated from a hybridization between two sexual species, the sailfin molly (Poecilia latipinna) and the Atlantic molly (Poecilia mexicana). The Amazon molly reproduces clonally via sperm-dependent parthenogenesis (gynogenesis), in which the sperm of closely related species triggers embryogenesis of the apomictic oocytes, but typically does not contribute genetic material to the next generation. We compare for the first time the gonadal transcriptome of the Amazon molly to those of both ancestral species, P. mexicana and P. latipinna. Results We sequenced the gonadal transcriptomes of the P. formosa and its parental species P. mexicana and P. latipinna using Illumina RNA-sequencing techniques (paired-end, 100 bp). De novo assembly of about 50 million raw read pairs for each species was performed using Trinity, yielding 106,922 transcripts for P. formosa, 115,175 for P. latipinna, and 133,025 for P. mexicana after eliminating contaminations. On the basis of sequence similarity comparisons to other teleost species and the UniProt databases, functional annotation, and differential expression analysis, we demonstrate the similarity of the transcriptomes among the three species. More than 40% of the transcripts for each species were functionally annotated and about 70% were assigned to orthologous genes of a closely related species. Differential expression analysis between the sexual and unisexual species uncovered 2035 up-regulated and 564 down-regulated genes in P. formosa. This was exemplary validated for six genes by qRT-PCR. Conclusions We identified more than 130 genes related to meiosis and reproduction within the apomictically reproducing P. formosa. Overall expression of these genes seems to be down-regulated in the P. formosa transcriptome compared to both ancestral species (i.e., 106 genes down-regulated, 29 up-regulated). A further 35 meiosis and reproduction related genes were not found in the P. formosa transcriptome, but were only expressed in the sexual species. Our data support the hypothesis of general down-regulation of meiosis-related genes in the apomictic Amazon molly. Furthermore, the obtained dataset and identified gene catalog will serve as a resource for future research on the molecular mechanisms behind the reproductive mode of this unisexual species. T3 - Zweitveröffentlichungen der Universität Potsdam : Mathematisch-Naturwissenschaftliche Reihe - 412 KW - Differential gene expression KW - Gynogenesis KW - Hybrid speciation KW - Meiosis KW - Poecilia formosa KW - Poecilia latipinna KW - Poecilia mexicana Y1 - 2018 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-409299 ER - TY - GEN A1 - Fliesser, Michael A1 - De Witt Huberts, Jessie A1 - Wippert, Pia-Maria T1 - The choice that matters: the relative influence of socioeconomic status indicators on chronic back pain BT - a longitudinal study T2 - Postprints der Universität Potsdam : Humanwissenschaftliche Reihe N2 - Background In health research, indicators of socioeconomic status (SES) are often used interchangeably and often lack theoretical foundation. This makes it difficult to compare results from different studies and to explore the relationship between SES and health outcomes. To aid researchers in choosing appropriate indicators of SES, this article proposes and tests a theory-based selection of SES indicators using chronic back pain as a health outcome. Methods Strength of relationship predictions were made using Brunner & Marmot’s model of ‘social determinants of health’. Subsequently, a longitudinal study was conducted with 66 patients receiving in-patient treatment for chronic back pain. Sociodemographic variables, four SES indicators (education, job position, income, multidimensional index) and back pain intensity and disability were obtained at baseline. Both pain dimensions were assessed again 6 months later. Using linear regression, the predictive strength of each SES indicator on pain intensity and disability was estimated and compared to the theory based prediction. Results Chronic back pain intensity was best predicted by the multidimensional index (beta = 0.31, p < 0.05), followed by job position (beta = 0.29, p < 0.05) and education (beta = −0.29, p < 0.05); whereas, income exerted no significant influence. Back pain disability was predicted strongest by education (beta = −0.30, p < 0.05) and job position (beta = 0.29, p < 0.05). Here, multidimensional index and income had no significant influence. Conclusions The choice of SES indicators influences predictive power on both back pain dimensions, suggesting SES predictors cannot be used interchangeably. Therefore, researchers should carefully consider prior to each study which SES indicator to use. The introduced framework can be valuable in supporting this decision because it allows for a stable prediction of SES indicator influence and their hierarchy on a specific health outcomes. T3 - Zweitveröffentlichungen der Universität Potsdam : Humanwissenschaftliche Reihe - 377 KW - Socioeconomic status KW - Indicators of socioeconomic status, Health inequality KW - Education KW - Job position KW - Income KW - Chronic back pain Y1 - 2018 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-407422 SN - 1866-8364 IS - 377 ER - TY - THES A1 - Villatoro Leal, José Andrés T1 - A combined approach for the analysis of biomolecules using IR-MALDI ion mobility spectrometry and molecular dynamics simulations of peptide ions in the gas phase T1 - Kombinierter Einsatz von IR-MALDI Ionenmobilitätsspektrometrie und Simulationen der Molekulardynamik von Peptidionen in der Gasphase zur Analyse von Biomolekülen N2 - The aim of this doctoral thesis was to establish a technique for the analysis of biomolecules with infrared matrix-assisted laser dispersion (IR-MALDI) ion mobility (IM) spectrometry. The main components of the work were the characterization of the IR-MALDI process, the development and characterization of different ion mobility spectrometers, the use of IR-MALDI-IM spectrometry as a robust, standalone spectrometer and the development of a collision cross-section estimation approach for peptides based on molecular dynamics and thermodynamic reweighting. First, the IR-MALDI source was studied with atmospheric pressure ion mobility spectrometry and shadowgraphy. It consisted of a metal capillary, at the tip of which a self-renewing droplet of analyte solution was met by an IR laser beam. A relationship between peak shape, ion desolvation, diffusion and extraction pulse delay time (pulse delay) was established. First order desolvation kinetics were observed and related to peak broadening by diffusion, both influenced by the pulse delay. The transport mechanisms in IR-MALDI were then studied by relating different laser impact positions on the droplet surface to the corresponding ion mobility spectra. Two different transport mechanisms were determined: phase explosion due to the laser pulse and electrical transport due to delayed ion extraction. The velocity of the ions stemming from the phase explosion was then measured by ion mobility and shadowgraphy at different time scales and distances from the source capillary, showing an initially very high but rapidly decaying velocity. Finally, the anatomy of the dispersion plume was observed in detail with shadowgraphy and general conclusions over the process were drawn. Understanding the IR-MALDI process enabled the optimization of the different IM spectrometers at atmospheric and reduced pressure (AP and RP, respectively). At reduced pressure, both an AP and an RP IR-MALDI source were used. The influence of the pulsed ion extraction parameters (pulse delay, width and amplitude) on peak shape, resolution and area was systematically studied in both AP and RP IM spectrometers and discussed in the context of the IR-MALDI process. Under RP conditions, the influence of the closing field and of the pressure was also examined for both AP and RP sources. For the AP ionization RP IM spectrometer, the influence of the inlet field (IF) in the source region was also examined. All of these studies led to the determination of the optimal analytical parameters as well as to a better understanding of the initial ion cloud anatomy. The analytical performance of the spectrometer was then studied. Limits of detection (LOD) and linear ranges were determined under static and pulsed ion injection conditions and interpreted in the context of the IR-MALDI mechanism. Applications in the separation of simple mixtures were also illustrated, demonstrating good isomer separation capabilities and the advantages of singly charged peaks. The possibility to couple high performance liquid chromatography (HPLC) to IR-MALDI-IM spectrometry was also demonstrated. Finally, the reduced pressure spectrometer was used to study the effect of high reduced field strength on the mobility of polyatomic ions in polyatomic gases. The last focus point was on the study of peptide ions. A dataset obtained with electrospray IM spectrometry was characterized and used for the calibration of a collision cross-section (CCS) determination method based on molecular dynamics (MD) simulations at high temperature. Instead of producing candidate structures which are evaluated one by one, this semi-automated method uses the simulation as a whole to determine a single average collision cross-section value by reweighting the CCS of a few representative structures. The method was compared to the intrinsic size parameter (ISP) method and to experimental results. Additional MD data obtained from the simulations was also used to further analyze the peptides and understand the experimental results, an advantage with regard to the ISP method. Finally, the CCS of peptide ions analyzed by IR-MALDI were also evaluated with both ISP and MD methods and the results compared to experiment, resulting in a first validation of the MD method. Thus, this thesis brings together the soft ionization technique that is IR-MALDI, which produces mostly singly charged peaks, with ion mobility spectrometry, which can distinguish between isomers, and a collision cross-section determination method which also provides structural information on the analyte at hand. N2 - Das Ziel dieser Arbeit war die Zusammenführung der schonende Ionisationsquelle Infrared Matrix-Assisted Laser Dispersion Ionization (IR-MALDI), der Isomer-diskriminierende Ionenmobilitätsspektrometrie und einer neuartigen, auf Molecular Dynamics (MD) Simulationen basierte Berechnungsmethode für Stoßquerschnitte. Der erste Schritt war die Charakterisierung des Flüssigkeitsdispersionsphänomens in IR-MALDI: Zwei verschiedenen Ionentransportmechanismen wurden nachgewiesen und weiter studiert. Die Beziehung zwischen Peakform, Diffusion, Desolvatation und Ionen Extraktionspuls wurde beschrieben. Die Geschwindigkeit der Ionen, die aus dem Dispersionsphänomen stammen, wurde durch Ionenmobilitätsspektrometrie und Shadowgraphie untersucht. Shadowgraphie hat ebenfalls das Verhalten des Dispersionsphänomens erläutert. Eine hohe, schnell abklingende initielle Geschwindigkeit wurde beobachtet. Das Verständnis des IR-MALDI Verfahrens ermöglichte die Optimierung der verschiedenen Ionenmobilität (IM) Spektrometer zum analytischen Zweck. Eine Atmosphärendruck- und zwei Niederdruckvariante von IM Spektrometern wurden mit gepulster Ionenextraktion genutzt. Die Pulsparameter (Pulsverzögerung, ‑breite, -höhe) und verschiedene elektrische Felder an unterschiedlichen Stellen der Spektrometer wurden systematisch variiert. Deren Einfluss auf die Peakauflösung und -fläche wurde untersucht und im Rahmen des IR-MALDI Verfahrens erklärt. Das Verständnis der Anatomie der Anfangsionenwolke wurde ebenfalls durch diese Experimente vertieft. Die analytische Leistungsfähigkeit eines IM-Spektrometers wurde dann untersucht. Nachweisgrenzen und lineare Bereiche wurden bestimmt und in Zusammenhang mit dem IR-MALDI Verfahren interpretiert. Anhand der Trennung von Isomeren und einfachen Mischungen wurde die Anwendung dieser Technik demonstriert und ihre Vorteile, die Detektion einfachgeladener Ionen und die Möglichkeit der HPLC-Kopplung (High Performance Liquid Chromatography), aufgezeigt. Mit dem Niederdruckspektrometer wurde der Einfluss hoher reduzierter Feldstärken auf die Ionenmobilität von polyatomische Ionen in polyatomische Gasen untersucht. Der letzte Schwerpunkt war die Charakterisierung von Peptidionen. Die Peptiden wurden mit Elektrospray (ESI) IM-Spektrometrie vermessen. Der hieraus erhaltene Datensatz diente zur Etablierung einer Stoßquerschnitt Berechnungsmethode mittels MD. Anstatt verschiedener Kandidat-Strukturen und deren Stoßquerschnitte, ergibt diese neuartige semi-automatisierte Methode einen einzigen, gemittelten Stoßquerschnitt. Die MD Methode wurde dann mit einer anderen, einfacheren Methode und mit den experimentellen Ergebnissen von ESI und IR-MALDI-IM Spektrometrie verglichen. Zudem wurde der Zusammenhang zwischen Ladungszustands- und Stoßquerschnittsdifferenzen zwischen den Peptiden untersucht. Weitere Strukturelle Informationen konnten aus den Simulationen extrahiert, und zur Charakterisierung der Peptiden verwendet werden. KW - Ion mobility spectrometry KW - Molecular dynamics KW - IR-MALDI KW - Peptides KW - Shadowgraphy KW - Liquid dispersion KW - Ionenmobilitätsspektrometrie KW - Molekulardynamik KW - Collision cross-section KW - IR-MALDI KW - Peptiden KW - Shadowgraphie KW - Stoßquerschnitt KW - Flüssigkeitszerstäubung Y1 - 2018 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:517-opus4-419723 ER -