Jacob Kongsted
Syddansk Universitet
H-index: 60
Europe-Denmark
Top articles of Jacob Kongsted
Title | Journal | Author(s) | Publication Date |
|---|---|---|---|
Reduced density matrix formulation of quantum linear response | arXiv preprint arXiv:2404.16586 | Theo Juncker von Buchwald Karl Michael Ziems Erik Rosendahl Kjellgren Stephan Sauer Jacob Kongsted | 2024/4/25 |
Electric Field Gradient Calculations for Ice VIII and IX using Polarizable Embedding: A Comparative Study on Classical Computers and Quantum Simulators | arXiv preprint arXiv:2404.14531 | Dániel Nagy Peter Reinholdt Phillip WK Jensen Erik Rosendahl Kjellgren Karl Michael Ziems | 2024/4/22 |
The variational quantum eigensolver self-consistent field method within a polarizable embedded framework | The Journal of Chemical Physics | Erik Rosendahl Kjellgren Peter Reinholdt Aaron Fitzpatrick Walter N Talarico Phillip WK Jensen | 2024/3/28 |
Color Tuning in Bovine Rhodopsin through Polarizable Embedding | The Journal of Physical Chemistry B | Duccio Di Prima Peter Reinholdt Jacob Kongsted | 2024/3/15 |
Subspace methods for the simulation of molecular response properties on a quantum computer | arXiv preprint arXiv:2402.12186 | Peter Reinholdt Erik Rosendahl Kjellgren Juliane Holst Fuglsbjerg Karl Michael Ziems Sonia Coriani | 2024/2/19 |
Synthesis and characterization of novel intrinsically fluorescent analogs of cholesterol with improved photophysical properties. | bioRxiv | Max Lehmann Peter Reinholdt Mohammad Bashawat Holger A Scheidt Senjuti Halder | 2023 |
Analytic geometric gradients for the polarizable density embedding model | International Journal of Quantum Chemistry | Peter Reinholdt Willem Van den Heuvel Jacob Kongsted | 2023/9/15 |
Which options exist for NISQ-friendly linear response formulations? | arXiv preprint arXiv:2312.13937 | Karl Michael Ziems Erik Rosendahl Kjellgren Peter Reinholdt Phillip WK Jensen Stephan Sauer | 2023/12/21 |
Natamycin interferes with ergosterol-dependent lipid phases in model membranes | BBA advances | Vibeke Akkerman Holger A Scheidt Peter Reinholdt Mohammad Bashawat Maria Szomek | 2023/1/1 |
Facile Suzuki Coupling Strategy toward New Nile Red Derivatives with Improved Two‐Photon Brightness | European Journal of Organic Chemistry | Mads W Mulberg Mick Hornum Peter Reinholdt Brian Bjarke Jensen Maria Szomek | 2023/6/1 |
Quantum Equation of Motion with Orbital Optimization for Computing Molecular Properties in Near-Term Quantum Computing | arXiv preprint arXiv:2312.12386 | Phillip WK Jensen Erik Rosendahl Kjellgren Peter Reinholdt Karl Michael Ziems Sonia Coriani | 2023/12/19 |
Substrate selectivity and inhibition of histidine JmjC hydroxylases MINA53 and NO66 | RSC Chemical Biology | Vildan A Türkmen Jordi CJ Hintzen Anthony Tumber Laust Moesgaard Eidarus Salah | 2023 |
Molecular recognition of methacryllysine and crotonyllysine by the AF9 YEATS domain | International Journal of Molecular Sciences | Nurgül Bilgin Laust Moesgaard Mohammad M Rahman Vildan A Türkmen Jacob Kongsted | 2023/4/10 |
Structure-based discovery of novel P-glycoprotein inhibitors targeting the nucleotide binding domains | Scientific Reports | Laust Moesgaard Maria L Pedersen Carsten Uhd Nielsen Jacob Kongsted | 2023/12/1 |
The importance of solvent effects in calculations of NMR coupling constants at the doubles corrected higher random-phase approximation | Magnetochemistry | Louise Møller Jessen Peter Reinholdt Jacob Kongsted Stephan PA Sauer | 2023/4/6 |
Accuracy of One-and Two-Photon Intensities with the Extended Polarizable Density Embedding Model | The Journal of Physical Chemistry B | Ernst Dennis Larsson Peter Reinholdt Erik Donovan Hedegård Jacob Kongsted | 2023/11/10 |
Embedding Beyond Electrostatics: The Extended Polarizable Density Embedding Model | The Journal of Physical Chemistry B | Willem Van den Heuvel Peter Reinholdt Jacob Kongsted | 2023/4/1 |
The Role of Trp79 in β‐Actin on Histidine Methyltransferase SETD3 Catalysis | ChemBioChem | Mays SQ Al‐Fakhar Nurgül Bilgin Laust Moesgaard Apolonia Witecka Jakub Drozak | 2023/11/2 |
Importance of Ile71 in β-actin on histidine methyltransferase SETD3 catalysis | Organic & Biomolecular Chemistry | Nurgül Bilgin Laust Moesgaard Marijn N Maas Jordi CJ Hintzen Apolonia Witecka | 2022 |
Multiconfigurational SCF and Short-Range DFT Combined with Polarizable Density Embedding: Comparison of Linear-Response and State-Specific Solvatochromic Shifts of Acrolein and … | Journal of Chemical Theory and Computation | Willem Van den Heuvel Peter Reinholdt Hans Jørgen Aa Jensen Jacob Kongsted | 2022/9/22 |
