Research output per year
Research output per year
Personal profile
Research Interests
Theoretical Chemistry, Computational Chemistry, Molecular Simulations, Computational Biophysics
Fingerprint
Dive into the research topics where Jacob Kongsted is active. These topic labels come from the works of this person. Together they form a unique fingerprint.
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Collaborations and top research areas from the last five years
Recent external collaboration on country/territory level. Dive into details by clicking on the dots or
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Exact Two-Component Relativistic Polarizable Density Embedding
Larsson, E. D., Reinholdt, P., Kongsted, J. & Hedegård, E. D., 18. Apr 2025, (E-pub ahead of print) In: Journal of Chemical Theory and Computation.Research output: Contribution to journal › Journal article › Research › peer-review
Open AccessFile -
Fluorescent Rhodopsins: A Challenging Test for Cost-Effective QM/MM Approaches
Di Prima, D., Pedraza-González, L., Reinholdt, P., Kongsted, J. & Mennucci, B., 13. Feb 2025, In: Journal of Physical Chemistry A. 129, 6, p. 1769-1778Research output: Contribution to journal › Journal article › Research › peer-review
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Importance of the 3′-phosphate group of acetyl-coenzyme A for efficient histone lysine acetyltransferase catalysis
Bilgin, N., Moesgaard, L., Proietti, G., Kongsted, J. & Mecinović, J., 2025, In: Chemical Communications.Research output: Contribution to journal › Journal article › Research › peer-review
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Self-consistent Quantum Linear Response with a Polarizable Embedding Environment
Reinholdt, P., Kjellgren, E., Ziems, K. M., Coriani, S., Sauer, S. P. A. & Kongsted, J., 2025, In: Journal of Physical Chemistry A. 129, 5, p. 1504-1515Research output: Contribution to journal › Journal article › Research › peer-review
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Understanding and mitigating noise in molecular quantum linear response for spectroscopic properties on quantum computers
Ziems, K. M., Kjellgren, E. R., Sauer, S. P. A., Kongsted, J. & Coriani, S., 5. Mar 2025, In: Chemical Science. 16, 10, p. 4456-4468Research output: Contribution to journal › Journal article › Research › peer-review
Open AccessFile
Activities
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Journal of Chemical Theory and Computation (Journal)
Kongsted, J. (Peer reviewer)
2018Activity: Editorial work and peer review › Peer review of manuscripts › Research
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Physical Chemistry Chemical Physics (Journal)
Kongsted, J. (Peer reviewer)
2018Activity: Editorial work and peer review › Peer review of manuscripts › Research
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Physical Chemistry Chemical Physics (Journal)
Kongsted, J. (Peer reviewer)
2018Activity: Editorial work and peer review › Peer review of manuscripts › Research
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Physical Chemistry Chemical Physics (Journal)
Kongsted, J. (Peer reviewer)
2018Activity: Editorial work and peer review › Peer review of manuscripts › Research
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Physical Chemistry Chemical Physics (Journal)
Kongsted, J. (Peer reviewer)
2018Activity: Editorial work and peer review › Peer review of manuscripts › Research
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Novo Nordisk Fonden - Center for Pharmaceutical Data Science Education
Kongsted, J. (Project participant)
01/09/2024 → 31/08/2030
Project: Private Foundations
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Uddannelses- og Forskningsmininsteriet - FNU - FP1 - Has the time come to realize quantum computing for transition metal complexes?
Kongsted, J. (Project participant)
01/01/2025 → 31/12/2027
Project: Research Councils
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Uddannelses- og Forskningsministeriet - DelC - Exploration of novel error mitigation strategies for quantum chemistry on noisy intermediate-scale quantum computers
Kongsted, J. (Project participant)
01/08/2024 → 31/07/2027
Project: Research Councils
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Uddannelses- og forskningsministeriet - Optogenetics from a molecular perspective – rational design strategies for microbial rhodopsins
Kongsted, J. (Project participant)
01/09/2022 → 31/12/2025
Project: Research Councils
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Novo Nordisk Fonden - Understanding P-glycoprotein inhibition from a molecular basis – development of rational design strategies for P-glycoprotein inhibitors
Kongsted, J. (Project participant)
01/09/2021 → 31/08/2024
Project: Research
Datasets
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Dataset for the tutorial: "Response properties of embedded molecules through the polarizable embedding model"
Steinmann, C. (Creator), Reinholdt, P. (Creator), Nørby, M. S. (Creator), Kongsted, J. (Creator) & Olsen, J. M. H. (Creator), Zenodo, 6. Apr 2018
Dataset
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Embedding potentials of aqueous acrolein
Hršak, D. (Creator), Olsen, J. M. H. (Creator) & Kongsted, J. (Creator), Zenodo, 16. Jan 2018
DOI: 10.5281/zenodo.1149061, https://zenodo.org/record/1149061
Dataset
Press/Media
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Danmarks Frie Forskningsfond får 34 nye fagrådsmedlemmer i 2025
30/10/2024
1 Media contribution
Press/Media: Press / Media
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DFF-bevillinger booster 11 forskningsprojekter på Det Naturvidenskabelige Fakultet
23/10/2024
1 Media contribution
Press/Media: Press / Media
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Nyt center skal fremtidssikre uddannelse af eksperter til dansk life science
08/10/2024
1 Media contribution
Press/Media: Press / Media
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PRM / Nyt uddannelsestilbud fremtidssikrer eksperter til dansk life sciencer
04/09/2024
1 Media contribution
Press/Media: Press / Media
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Nyt uddannelsestilbud fremtidssikrer eksperter til dansk life sciencer
04/09/2024
1 Media contribution
Press/Media: Press / Media