CORDIS Project
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This project aims to revolutionize the modeling of molecular interactions in large systems using quantum field theory. It focuses on developing efficient computational methods to study complex biological systems, such as protein and DNA complexes, with millions of atoms under various external conditions.
The quantum-mechanical theory of molecular interactions is firmly established, however its applicability to large molecular complexes is hindered by the rather high computational cost of quantum calculations required to achieve high accuracy.
We propose a paradigm shift in the modeling and conceptual understanding of electrostatic and electrodynamic molecular interactions in many-particle systems from the perspective of (quantum) field theory.
This development is critical to accurately and effic…
UNIVERSITE DU LUXEMBOURG
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