Christoph R Jacob

27PUBLICATIONS
71CO-AUTHORS
Computational chemistryTheoretical quantum chemistryAutomated software engineeringReaction engineering (excl. nuclear reactions)Chemical and thermal processes in energy and combustion
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Publications (27)

|Mar 04, 2026
Uncertainty Quantification for In Silico Chemistry.

Tom Frömbgen, Elizaveta Surzhikova, Jürgen Dölz

|Feb 23, 2026
Benchmarking of vibrational exciton models against quantum-chemical localized-mode calculations.

Anna M van Bodegraven, Kevin Focke, Mario Wolter

|Apr 22, 2025
The Amsterdam Modeling Suite.

Evert Jan Baerends, Nestor F Aguirre, Nick D Austin

|Apr 16, 2025
The density-based many-body expansion for poly-peptides and proteins.

Johannes R Vornweg, Toni M Maier, Christoph R Jacob

|Nov 17, 2024
Protein-Ligand Interaction Energies from Quantum-Chemical Fragmentation Methods: Upgrading the MFCC-Scheme with Many-Body Contributions.

Johannes R Vornweg, Christoph R Jacob

|Oct 03, 2024
Biocatalytic Ether Lipid Synthesis by an Archaeal Glycerolprenylase.

Felix Kaspar, Lea Eilert, Sophie Staar

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Frequent Collaborators

10 joint publications

Mario Wolter

7 joint publications

Felix Brandt

4 joint publications

Johannes Vornweg

3 joint publications

Anett Schallmey