Foundational Implicit Solvent Machine Learning Potentials for Organic Molecules
Subproject of Priority Programme SPP 2363: Utilization and Development of Machine Learning for Molecular Applications – Molecular Machine Learning

Die Professuren des Department of Engineering Physics and Computation forschen an den verschiedensten physikalischen Grundlagen. Auf dieser Seite präsentieren sie eine Auswahl von besonderen Forschungsthemen aus dem Department. Weitere Forschungsprojekte stellen die Professuren auf ihren Webseiten vor.
Subproject of Priority Programme SPP 2363: Utilization and Development of Machine Learning for Molecular Applications – Molecular Machine Learning
Additive Manufacturing (AM) by Laser Powder Bed Fusion (LPBF) has the potential to revolutionize future product development, design and supply chains. Since the underlying multi-scale physics are not…
Alloy microstructure prediction and control are essential in advancing additive manufacturing technology. Of significant technological interest is, in particular, the laser powder bed fusion due to…
ProjektwebseiteSevering manufacturing processes such as shear cutting use mechanical mechanisms to break up the material cohesion of work pieces. In this process, highly non-linear deformations and complex…
Supramolecular self-assembly is a fundamental process abundantly utilized by nature and emerging functional materials technologies ranging from drug delivery to soft semiconductor devices. Recently,…
ProjektwebseiteDie Fahrdynamikregelung stellt eine zentrale Funktion automatisierter Fahrzeuge dar. Die relevanten Effekte lassen sich in Positions- und Geschwindigkeitsdynamik, sowie in Längs- und Querdynamik…
The prediction and control of thermoacoustic combustion instabilities (TCIs) poses severe challenges to the development of efficient lean premixed combustion systems. A crucial input for current TCI…
ProjektwebseiteThe principal objective of the proposed research project, which spans over all three planned phases, is the development, flexibilization, and industrial implementation of a property-controlled…
ProjektwebseiteThe analysis, (control) design and optimization of dynamical systems with spatially distributed parameters is often based on high-dimensional discretized models, as they result e.g. from a finite…
ProjektwebseiteSelf-excited oscillations resulting from flow-acoustic or flow-flame-acoustic feedback mechanisms can generate very high levels of pulsations in applications such as power plants or gas transportation…
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