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Institute
A highly stereoselective recombinant alcohol dehydrogenase aus 'Pseudomonas fluorescens' DSM50106
(2005)
The alcohol dehydrogenase was biochemically characterized. A broad range of arylaliphatic ketones is efficiently reduced to the corresponding optically active (R)-alcohols by a recombinant alcohol dehydrogenase (PF-ADH) produced by overexpression in 'Escherichia coli'. PF-ADH shows high activity and stereoselectivity in the reduction of acetophenone and various derivatives (45-99%), as well as in the reduction of 3-oxy-butyric acid methyl ester and 3-oxy-butyric acid methyl ester and 3-oxy-hexanoic acid ethyl ester (>99%). The highest activity was observed between 10 and 20°C. The copfactor NADH can be efficiently recycled by the addition of 10-20% of iso-propanol. A flow-through-polarimetry-based assay to determine oxidoreductase activity and stereoselectivity is described.
This work studies different alternatives for parallelization of ground-state DMRG, with a focus on shared memory multiprocessor systems. Exploiting the parallelism in the dominant part of a DMRG calculation (diagonalization of the superblock Hamiltonian), speedups of 5 to 6 on 8-CPU machines can be achieved. A performance analysis gives hints as to which machine is best siuted for the task. The parallelized DMRG code is then applied to current problems in theoretical solid state physics with electronics, bosonic and spin degrees of freedom. Stripe-like modulations of the hole density in the ground state of doped Hubbard with cylindrical boundary conditions are idenficied in the thermodynamic limit using extrapolation techniques. In the 1D Holstein model of spinless fermions at half filling, Luttinger parameters and the charge structure factor are determinde in order to derive the phase diagram that had previously been established only on small lattices. For the 1D half-filled Holstein-Hubbard model, a finite size analysisof spine and charge excitation gaps in the relevant sectors (Mott insulator, Peierls band insulator and bipolaronic Peierls insulator) is able to yield the phase diagram as well. Finally, is the Heisenberg spin chain with dynamical phonons is considered as a relevant model for a spin-Peierls transition in Copper Germanate. Using DMRG, the relation between singlet-triplet excitation gap and dynamical dimeriaztion is calculated for the first time.
The present work is a paleolimnological orientated approach to refine and improve the indicator ability of freshwater ostracods from Holocene and Late glacial deposits in northeast Germany. The thesis follows two different approaches, one utilizes quantitative paleoenvironmental analysis, while the other evaluates ecological investigations of living specimens to extend the potential indicator group. For the first time quantitative ostracod analysis are carried out for a lacustrine basin (lake Krakower See) and a near-shore locality (Pudagla lowland) in the study area. The ecological investigation of living ostracods comprises 96 localities. The evaluation focused on environmental variables, which explain significantly the species composition. A canonical correspondence analysis identified at least four environmental parameters - water temperature, conductivity, pH-value, and mean water depth – which have an effect on ostracod assemblages. An extended analysis, which included only a subset of lake sites, revealed also that the former three environmental parameters affect the ostracod lake fauna, whereas the water temperature is the dominant factor. A temperature-transfer function could be regressed and calculated from the given trainingset by a weighted average model. These estimates can now be use in future paleolimnological investigations in northeast Germany to quantify the paleotemperature.