@article{SchmidtSaxenhoferDrewesetal.2016,
  author    = {Schmidt, Sabrina and Saxenhofer, Moritz and Drewes, Stephan and Schlegel, Mathias and Wanka, Konrad M. and Frank, Raphael and Klimpel, Sven and von Blanckenhagen, Felix and Maaz, Denny and Herden, Christiane and Freise, Jona and Wolf, Ronny and Stubbe, Michael and Borkenhagen, Peter and Ansorge, Hermann and Eccard, Jana and Lang, Johannes and Jourdain, Elsa and Jacob, Jens and Marianneau, Philippe and Heckel, Gerald and Ulrich, Rainer G{\"u}nter},
  title     = {High genetic structuring of Tula hantavirus},
  series = {Archives of virology},
  volume    = {161},
  journal   = {Archives of virology},
  publisher = {Springer},
  address   = {Wien},
  issn      = {0304-8608},
  doi       = {10.1007/s00705-016-2762-6},
  pages     = {1135 -- 1149},
  year      = {2016},
  abstract  = {Tula virus (TULV) is a vole-associated hantavirus with low or no pathogenicity to humans. In the present study, 686 common voles (Microtus arvalis), 249 field voles (Microtus agrestis) and 30 water voles (Arvicola spec.) were collected at 79 sites in Germany, Luxembourg and France and screened by RT-PCR and TULV-IgG ELISA. TULV-specific RNA and/or antibodies were detected at 43 of the sites, demonstrating a geographically widespread distribution of the virus in the studied area. The TULV prevalence in common voles (16.7 \%) was higher than that in field voles (9.2 \%) and water voles (10.0 \%). Time series data at ten trapping sites showed evidence of a lasting presence of TULV RNA within common vole populations for up to 34 months, although usually at low prevalence. Phylogenetic analysis demonstrated a strong genetic structuring of TULV sequences according to geography and independent of the rodent species, confirming the common vole as the preferential host, with spillover infections to co-occurring field and water voles. TULV phylogenetic clades showed a general association with evolutionary lineages in the common vole as assessed by mitochondrial DNA sequences on a large geographical scale, but with local-scale discrepancies in the contact areas.},
  language  = {en}
}
@article{SchmidtWalzJonesetal.2016,
  author    = {Schmidt, Katja and Walz, Ariane and Jones, Isobel and Metzger, Marc J.},
  title     = {The Sociocultural Value of Upland Regions in the Vicinity of Cities in Comparison With Urban Green Spaces},
  series = {Mountain research and development},
  volume    = {36},
  journal   = {Mountain research and development},
  publisher = {American Geophysical Union},
  address   = {Lawrence},
  issn      = {0276-4741},
  doi       = {10.1659/MRD-JOURNAL-D-16-00044.1},
  pages     = {465 -- 474},
  year      = {2016},
  language  = {en}
}
@misc{SchmidtSachseWalz2016,
  author    = {Schmidt, Katja and Sachse, Rene and Walz, Ariane},
  title     = {Current role of social benefits in ecosystem service assessments},
  series = {Landscape and urban planning : an international journal of landscape ecology, planning and design},
  volume    = {149},
  journal   = {Landscape and urban planning : an international journal of landscape ecology, planning and design},
  publisher = {Elsevier},
  address   = {Amsterdam},
  issn      = {0169-2046},
  doi       = {10.1016/j.landurbplan.2016.01.005},
  pages     = {49 -- 64},
  year      = {2016},
  abstract  = {Ecosystem services have a significant impact on human wellbeing. While ecosystem services are frequently represented by monetary values, social values and underlying social benefits remain underexplored. The purpose of this study is to assess whether and how social benefits have been explicitly addressed within socio-economic and socio-cultural ecosystem services research, ultimately allowing a better understanding between ecosystem services and human well-being. In this paper, we reviewed 115 international primary valuation studies and tested four hypotheses associated to the identification of social benefits of ecosystem services using logistic regressions. Tested hypotheses were that (1) social benefits are mostly derived in studies that assess cultural ecosystem services as opposed to other ecosystem service types, (2) there is a pattern of social benefits and certain cultural ecosystem services assessed simultaneously, (3) monetary valuation techniques go beyond expressing monetary values and convey social benefits, and (4) directly addressing stakeholde\&\#341;s views the consideration of social benefits in ecosystem service assessments. Our analysis revealed that (1) a variety of social benefits are valued in studies that assess either of the four ecosystem service types, (2) certain social benefits are likely to co-occur in combination with certain cultural ecosystem services, (3) of the studies that employed monetary valuation techniques, simulated market approaches overlapped most frequently with the assessment of social benefits and (4) studies that directly incorporate stakeholder's views were more likely to also assess social benefits.},
  language  = {en}
}
@article{SchmidtRoedigerGruneretal.2016,
  author    = {Schmidt, Carsten and Roediger, Stefan and Gruner, Melanie and Moncsek, Anja and Stohwasser, Ralf and Hanack, Katja and Schierack, Peter and Schroeder, Christian},
  title     = {Multiplex localization of sequential peptide epitopes by use of a planar microbead chip},
  series = {Analytica chimica acta : an international journal devoted to all branches of analytical chemistry},
  volume    = {908},
  journal   = {Analytica chimica acta : an international journal devoted to all branches of analytical chemistry},
  publisher = {Elsevier},
  address   = {Amsterdam},
  issn      = {0003-2670},
  doi       = {10.1016/j.aca.2015.12.030},
  pages     = {150 -- 160},
  year      = {2016},
  abstract  = {Epitope mapping is crucial for the characterization of protein-specific antibodies. Commonly, small overlapping peptides are chemically synthesized and immobilized to determine the specific peptide sequence. In this study, we report the use of a fast and inexpensive planar microbead chip for epitope mapping. We developed a generic strategy for expressing recombinant peptide libraries instead of using expensive synthetic peptide libraries. A biotin moiety was introduced in vivo at a defined peptide position using biotin ligase. Peptides in crude Escherichia coli lysate were coupled onto streptavidin-coated microbeads by incubation, thereby avoiding tedious purification procedures. For read-out we used a multiplex planar microbead chip with size- and fluorescence-encoded microbead populations. For epitope mapping, up to 18 populations of peptide-loaded microbeads (at least 20 microbeads per peptide) displaying the primary sequence of a protein were analyzed simultaneously. If an epitope was recognized by an antibody, a secondary fluorescence-labeled antibody generated a signal that was quantified, and the mean value of all microbeads in the population was calculated. We mapped the epitopes for rabbit anti-PA28 gamma (proteasome activator 28 gamma) polyclonal serum, for a murine monoclonal antibody against PA28 gamma, and for a murine monoclonal antibody against the hamster polyoma virus major capsid protein VP1 as models. In each case, the identification of one distinct peptide sequence out of up to 18 sequences was possible. Using this approach, an epitope can be mapped multiparametrically within three weeks. (C) 2016 Elsevier B.V. All rights reserved.},
  language  = {en}
}
@article{SchmidtLorenz2016,
  author    = {Schmidt, Burkhard and Lorenz, Ulf},
  title     = {WavePacket},
  series = {Computer physics communications : an international journal devoted to computational physics and computer programs in physics},
  volume    = {213},
  journal   = {Computer physics communications : an international journal devoted to computational physics and computer programs in physics},
  publisher = {Elsevier},
  address   = {Amsterdam},
  issn      = {0010-4655},
  doi       = {10.1016/j.cpc.2016.12.007},
  pages     = {223 -- 234},
  year      = {2016},
  abstract  = {WavePacket is an open-source program package for the numerical simulation of quantum-mechanical dynamics. It can be used to solve time-independent or time-dependent linear Schr{\"o}dinger and Liouville-von Neumann-equations in one or more dimensions. Also coupled equations can be treated, which allows to simulate molecular quantum dynamics beyond the Born-Oppenheimer approximation. Optionally accounting for the interaction with external electric fields within the semiclassical dipole approximation, WavePacket can be used to simulate experiments involving tailored light pulses in photo-induced physics or chemistry. The graphical capabilities allow visualization of quantum dynamics 'on the fly', including Wigner phase space representations. Being easy to use and highly versatile, WavePacket is well suited for the teaching of quantum mechanics as well as for research projects in atomic, molecular and optical physics or in physical or theoretical chemistry. The present Part I deals with the description of closed quantum systems in terms of Schr{\"o}dinger equations. The emphasis is on discrete variable representations for spatial discretization as well as various techniques for temporal discretization. The upcoming Part II will focus on open quantum systems and dimension reduction; it also describes the codes for optimal control of quantum dynamics. The present work introduces the MATLAB version of WavePacket 5.2.1 which is hosted at the Sourceforge platform, where extensive Wiki-documentation as well as worked-out demonstration examples can be found.},
  language  = {en}
}
@article{SchmidtZiemannPentzienetal.2016,
  author    = {Schmidt, Birgit Angelika and Ziemann, Martin Andreas and Pentzien, Simone and Gabsch, Toralf and Koch, Werner and Kr{\"u}ger, J{\"o}rg},
  title     = {Technical analysis of a Central Asian wall painting detached from a Buddhist cave temple on the northern Silk Road},
  series = {Studies in Conservation},
  volume    = {61},
  journal   = {Studies in Conservation},
  publisher = {Routledge, Taylor \& Francis Group},
  address   = {Abingdon},
  issn      = {0039-3630},
  doi       = {10.1179/2047058414Y.0000000152},
  pages     = {113 -- 122},
  year      = {2016},
  abstract  = {A great number of Central Asian wall paintings, archeological materials, architectural fragments, and textiles, as well as painting fragments on silk and paper, make up the so called Turfan Collection at the Asian Art Museum in Berlin. The largest part of the collection comes from the Kucha region, a very important cultural center in the third to ninth centuries. Between 1902 and 1914, four German expeditions traveled along the northern Silk Road. During these expeditions, wall paintings were detached from their original settings in Buddhist cave complexes. This paper reports a technical study of a wall painting, existing in eight fragments, from the Buddhist cave no. 40 (Ritterhohle). Its original painted surface is soot blackened and largely illegible. Gruwedel, leader of the first and third expeditions, described the almost complete destruction of the rediscovered temple complex and evidence of fire damage. The aim of this case study is to identify the materials used for the wall paintings. Furthermore, soot deposits as well as materials from conservation interventions were of interest. Non-invasive analyses were preferred but a limited number of samples were taken to provide more precise information on the painting technique. By employing optical and scanning electron microscopy, energy dispersive X-ray spectroscopy, micro X-ray fluorescence spectroscopy, X-ray diffraction analysis, and Raman spectroscopy, a layer sequence of earthen render, a ground layer made of gypsum, and a paint layer containing a variety of inorganic pigments were identified.},
  language  = {en}
}
@article{SchmidtWolfEhlert2016,
  author    = {Schmidt, Bernd and Wolf, Felix and Ehlert, Christopher},
  title     = {Systematic Investigation into the Matsuda-Heck Reaction of alpha-Methylene Lactones: How Conformational Constraints Direct the beta-H-Elimination Step},
  series = {The journal of organic chemistry},
  volume    = {81},
  journal   = {The journal of organic chemistry},
  publisher = {American Chemical Society},
  address   = {Washington},
  issn      = {0022-3263},
  doi       = {10.1021/acs.joc.6b02207},
  pages     = {11235 -- 11249},
  year      = {2016},
  abstract  = {alpha-Methylene-gamma-butyrolactone and alpha-methylene-gamma-valerolactone undergo Pd-catalyzed Matsuda-Heck couplings with arene diazonium salts to alpha-benzyl butenolides or pentenolides, respectively, or to alpha-benzylidene lactones. The observed regioselectivity is strongly ring size dependent, with six-membered rings giving exclusively alpha-benzyl pentenolides, whereas the five-membered alpha-methylene lactone reacts to mixtures of regioisomers with a high proportion of (E)-alpha-benzylidene-gamma-butyrolactones. DFT calculations suggest that the reasons for these differences are not thermodynamic but kinetic in nature. The relative energies of the conformers of the Pd sigma-complexes resulting from insertion into the Pd-aryl bond were correlated with the dihedral angles between Pd and endo-beta-H. This correlation revealed that in the case of the six-membered lactone an energetically favorable conformer adopts a nearly synperiplanar Pd/endo-beta-H arrangement, whereas for the analogous Pd sigma-complex of the five-membered lactone the smallest Pd/endo-beta-H dihedral angle is observed for a conformer with a comparatively high potential energy. The optimized conditions for Matsuda-Heck arylations of exo-methylene lactones were eventually applied to the synthesis of the natural product anemarcoumarin A.},
  language  = {en}
}
@article{SchmidtWolfBrunner2016,
  author    = {Schmidt, Bernd and Wolf, Felix and Brunner, Heiko},
  title     = {Styrylsulfonates and -Sulfonamides through Pd-Catalysed Matsuda-Heck Reactions of Vinylsulfonic Acid Derivatives and Arenediazonium Salts},
  series = {European journal of organic chemistry},
  journal   = {European journal of organic chemistry},
  publisher = {Wiley-VCH},
  address   = {Weinheim},
  issn      = {1434-193X},
  doi       = {10.1002/ejoc.201600469},
  pages     = {2972 -- 2982},
  year      = {2016},
  abstract  = {Arene diazonium salts undergo Matsuda-Heck reactions with vinylsulfonates and -sulfonamides to give styrylsulfonic acid derivatives in high to excellent yields and with high to excellent selectivities. By quantifying the evolution of nitrogen over time in a gas-meter apparatus, the reactivities of ethylvinylsulfonate and the benchmark olefin methyl acrylate were compared for an electron-rich and an -deficient arene diazonium salt. Tertiary sulfonamides react in Matsuda-Heck couplings with high conversions, but require long reaction times, which prevents the determination of kinetic data through the measurement of nitrogen evolution. Secondary sulfonamides were found to be unreactive. From these results, the following order of reactivity could be deduced: H2C=CHCO2Me > H2C=CHSO2OEt > H2C=CHSO2N(Me)Bn >> H2C=CHSO2NHBn. Through the Matsuda-Heck coupling of 5-indolyldiazonium salt and a tertiary vinylsulfonamide, the synthesis of the C-5-substituted indole part of the antimigraine drug naratriptan was accomplished in high yield.},
  language  = {en}
}
@article{SchmidtRiemer2016,
  author    = {Schmidt, Bernd and Riemer, Martin},
  title     = {Microwave-Promoted Deprenylation: Prenyl Ether as a Thermolabile Phenol Protecting Group},
  series = {Synthesis},
  volume    = {48},
  journal   = {Synthesis},
  publisher = {Thieme},
  address   = {Stuttgart},
  issn      = {0039-7881},
  doi       = {10.1055/s-0035-1561366},
  pages     = {1399 -- 1406},
  year      = {2016},
  abstract  = {para-Substituted aryl prenyl ethers undergo a deprenylation reaction upon microwave irradiation. This offers the opportunity to use a prenyl ether as a thermolabile protecting group in the synthesis of natural products with a chromone structure, which proceeds via a tandem deprenylation/6-endo-cyclization sequence.},
  language  = {en}
}
@article{SchmidtRiemer2016,
  author    = {Schmidt, Bernd and Riemer, Martin},
  title     = {Synthesis of Allyl- and Prenylcoumarins via Microwave-Promoted Tandem Claisen Rearrangement/Wittig Olefination},
  series = {Synthesis},
  volume    = {48},
  journal   = {Synthesis},
  publisher = {Thieme},
  address   = {Stuttgart},
  issn      = {0039-7881},
  doi       = {10.1055/s-0035-1560501},
  pages     = {141 -- 149},
  year      = {2016},
  abstract  = {Allyl, dimethylallyl, crotyl, and prenyl ethers of various aromatic ortho-hydroxy carbonyl compounds undergo a tandem sequence of Claisen rearrangement, carbonyl olefination, and cyclization upon microwave irradiation in the presence of a stabilized ylide. The products are multiply substituted 6- or 8-allylated or prenylated coumarins (2H-chromen-2-ones).},
  language  = {en}
}