Projects
Hessian scientists of various disciplines are using High Performance Computers for their research.
Projects
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Projekte
Displaying 1 - 30 of 39
CompuGene Student Lab Protein Engineering
The field of protein engineering is a rapidly evolving area of research that holds great promise for numerous ...
Engineering SciencesComputer Science
Learning by Building: Construction of Voltage-Dependent Ion Channels from Modular Components II
Voltage-dependent K+ channels are facilitators of a diverse set of physiological processes, including neuronal signaling ...
Life Sciences
Machine Learning Application in Automotive Catalysts
The computational resources of the Lichtenberg HPC were used in this project to train physics informed machine learning ...
Natural SciencesChemical Solid State and Surface Research
Multiscale Modelling of Cement-Based Materials III
The project seeks to create a comprehensive model linking nanoscale phenomena to larger-scale behaviors to better ...
Engineering SciencesConstruction Engineering and Architecture
Computer-Aided Analysis of Time-Lapse Microscopy Data II
During development and adult homeostasis, cells in our bodies need to constantly integrate internal and external ...
Life SciencesBasic Research in Biology and Medicine-
High-Throughput Discovery of Mab and Mbene Superconductors
We survey the landscape of MAB and Mbene superconductors out of our previous high-throughput predictions using first ...
Natural SciencesTheoretical Condensed Matter Physics 
Improving the Model-Based Prediction of Vibroacoustic Vehicle Properties by Mastering Uncertainty
Vibroacoustic vehicle behavior specifies among others the quality of vehicles and contributes to customer satisfaction ...
Engineering SciencesMechanics and Constructive Mechanical Engineering
Learning by Building: Construction of Voltage-Dependent Ion Channels From Modular Components
As facilitators of ionic currents across biological membranes, voltage-dependent K+ channels are involved in a broad ...
Life SciencesBasic Research in Biology and Medicine
MD-Simulations to Study the Effect of Electric Fields on the SARS-CoV-2 Postfusion Structure
The interaction between the Spike (S) glycoprotein and the ACE2 receptor on the host cell constitutes the pivotal ...
Natural SciencesStatistical Physics, Soft Matter, Biological Physics, Nonlinear Dynamics
Multiscale Modelling of Cement-Based Materials II
The project aims to develop a bridging model that connects the nanoscale to the upscaled levels for understanding the ...
Engineering SciencesConstruction Engineering and Architecture-
Scientific Machine Learning for Chemical Kinetics
Detailed multi-scale modelling provides in-depth insights into the complex phenomena of catalytic systems that typically ...
Engineering SciencesProcess Engineering, Technical Chemistry 
CCDCGAN: Inverse design of crystal structures
Autonomous materials discovery with desired properties is one of the ultimate goals for modern materials science, and ...
Natural SciencesTheoretical Condensed Matter Physics-
Computer-Aided Analysis of Time-Lapse Microscopy Data I
During development and adult homeostasis, cells in our bodies need to constantly integrate internal and external ...
Life Sciences -
Generation of Training Data for a Gaussian Process Based Surrogate Model
This project was a follow-up project for our initial project intended at setting up Lichtenberg Cluster for the use ...
Engineering Sciences -
Implementation and Validation of an Approach for Statistical Parameter Calibration
The prediction accuracy of models is affected using deterministic parameters. That is because the uncertainty of these ...
Engineering SciencesMechanics and Constructive Mechanical Engineering -
Influence of Osmolytes on the Solvation of Peptides and Model-Peptides
Protein stability in the complex solution environment of the living cell depends on several environmental factors ...
Natural SciencesPhysical and Theoretical Chemistry 
Multiscale Modelling of Cement-Based Materials
Overall objective of this project is to develop an elementary physical/chemical bridging model for the chemical reaction ...
Engineering SciencesConstruction Engineering and Architecture-
Sensitivity Analysis of a Complex Multibody System
This project was a follow-up project for our initial project intended at setting up Lichtenberg Cluster for the use ...
Engineering Sciences 
Unraveling SARS-Cov-2 Spike Protein Conformational Dynamics Under the Influence of Electric Fields
The spike glycoprotein's interaction with the ACE2 receptor on the host cell is the crucial initial step for virus entry ...
Natural SciencesStatistical Physics, Soft Matter, Biological Physics, Nonlinear Dynamics
Ab-Initio Thermodynamics of Refractory Mo-Si-Ti Phases at High Temperatures
Refractory metal silicide systems like Mo-Si-Ti are expected to be ideal substrates in composite materials for high ...
Engineering SciencesMaterials Science
High-Throughput Design of New Perovskite Oxide Antiferroelectric Materials
Antiferroelectric (AFE) materials have recently been of a great interest, due to their unique applications in the energy ...
Natural SciencesTheoretical Condensed Matter Physics
Modeling of Large Proteins in DNA Repair
DNA-PKcs is a gateway protein of the Non-Homologous End Joining DNA Repair Pathway. Which is the process of repairing ...
Natural SciencesEngineering SciencesComputer Science
Molecular Dynamics Study of the Sodium/Potassium Channels HCN
Ion channels play a fundamental key role in all living organisms and are crucial for the signal transduction of neurons ...
Life SciencesBasic Research in Biology and Medicine
Multi-Scale Modeling of Additive Manufactured Magnetic Materials
In 2018, Gottschall et al. proposed a multi-stimulit concept for magnetocaloric cooling. [1] The energy consumption ...
Engineering SciencesMaterials Science
Probabilistic Power Plant Dispatch Prediction
To model future energy systems and their markets, it is important to understand the underlying dynamics of their ...
Engineering SciencesElectrical Engineering and Information Technology
Testing and Development of Methods for the Calculation of Phase Diagrams of Interatomic Potentials
Understanding the behavior of different materials not only furthers general knowledge, but can also often be used for ...
Natural SciencesStatistical Physics, Soft Matter, Biological Physics, Nonlinear Dynamics
A Cosolvent Surfactant Mechanism Affects Polymer Collapse in Miscible Good Solvents
The coil-globule transition of aqueous polymers is of profound significance in understanding the structure and function ...
Natural SciencesPhysical and Theoretical Chemistry-
Intelligent Optimization Process Through Reinforcement Learning
Lighting, both natural and artificial, has become a part of our daily lives that have been taken for granted in modern ...
Engineering SciencesElectrical Engineering and Information Technology 
Lifetime Portfolio Choice and Optimal Retirement Decisions
Millions of European and American workers are increasingly asked to accumulate pension assets. In order to augment ...
Humanities and Social SciencesEconomics
Molecular Dynamics Study of the Sodium/Potassium Channels HCN
Ion channels play a fundamental key role in all living organisms and are crucial for the signal transduction of neurons ...
Life SciencesBasic Research in Biology and Medicine
