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From Density Functional Theory to Tight Binding: Development of Robust and Efficient Quantum Chemistry Methods
(2022-12-07)
The main topics of this thesis are efficient quantum chemical methods, their development, and the verification using existing and newly devised benchmark sets. The spectrum of quantum chemical methods discussed here includes ...
Process models for the continuous manufacturing of tablets via direct compression
(2022-12-08)
The modularity of the continuous manufacturing line PCMM is accompanied by a complexity of parameter connections and process dependencies. To develop a holistic understanding of the continuous process, this work examined ...
Drug nanocrystals for the treatment of inflammatory bowel diseases (IBD)
(2022-12-08)
(noch nicht zugänglich / not yet accessible)
Regulation of inhibitory synaptic connections and distal neuronal complexity by the Ste20-like kinase Slk
(2022-11-28)
(noch nicht zugänglich / not yet accessible)
Optimal Control of Quasilinear Parabolic PDEs: Theory and Numerics
(2022-12-15)
This thesis is concerned with theory and numerics of optimal control of quasilinear parabolic PDEs. The underlying parabolic PDE models, e.g., heat conduction with temperature-dependent thermal conductivity and is highly ...
Deconstructing and Approaching Heterogeneities in the Biomedical Field via Computational Modeling
(2022-12-06)
Natural variation between human characteristics as well as differences across collected datasets in disparate medical or research centers on various levels (e.g., semantical and technical) lead to high heterogeneity in ...
Robust & Efficient Treatment of Industrial-Grade CAD Geometries for a Flat-Top Partition of Unity Method
(2022-12-15)
Even today, the treatment of industrial-grade geometries is a huge challenge in the field of numerical simulations. The geometries that are created by computer aided design (CAD) are often very complex and contain many ...
Quantitative and intuitive liver tumor treatment with multi-constrained planning and holographic augmented reality
(2022-12-15)
In recent years, thermal ablation has become a widely accepted minimal invasive treatment for liver tumor patients. However, surgical planning and performing are still challenging tasks in two aspects: on one hand, surgical ...
Amino acid N-acyltransferases in Human Metabolism
(2022-12-22)
The human enzymes GLYAT (glycine N-acyltransferase), GLYATL1 (glutamine N-phenylacetyltransferase) and GLYATL2 (glycine N-acyltransferase-like protein 2) are not only important in the detoxification of xenobiotics via the ...
Scalable 3D Reconstruction for Immersive Virtual Reality Applications
(2022-12-19)
The recent advances in Augmented Reality (AR) and Virtual Reality (VR) technology and their growing popularity in the past years has significantly influenced emerging trends towards more intuitive and user-centric applications ......