Computational Chemistry
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- 2026
-
Mark
Numerical studies of strong protein interactions
Vinterbladh, Isabel LU
(2026)
- Thesis › Licentiate thesis
- 2025
-
Mark
Characterization of rapeseed protein supramolecular structures obtained by aqueous extractions
- Contribution to journal › Article
-
Mark
Supercooled phase transitions in conformal dark sectors explain NANOGrav data
- Contribution to journal › Article
-
Mark
Minimal structural perturbation of Histatin 5 in crowded environments : Insights from small-angle X-ray scattering, dynamic light scattering, and computer simulations
Fagerberg, Eric LU ; Holmqvist, Peter LU ; Lenton, Samuel LU ; Pernot, Petra and Skepö, Marie LU
(2025)
In Journal of Colloid and Interface Science
700.
- Contribution to journal › Article
-
Mark
Reproducibility of QM/MM Calculations for the SARS-CoV-2 Main Protease
Sun, Xiaoli LU and Ryde, Ulf LU
(2025)
In Journal of Chemical Theory and Computation
21(15).
p.7711-7723
- Contribution to journal › Article
-
Mark
Rheology and dynamics of dense particle suspensions in rotary shear flows
Agrawal, Naveen Kumar ; Ge, Zhouyang ; Trulsson, Martin LU
; Tammisola, Outi
and Brandt, Luca
(2025)
In Journal of Fluid Mechanics
1018.
- Contribution to journal › Article
-
Mark
Understanding Anomalous Cage-Escape Dynamics in Photoredox Processes Driven by a Fe(III) N-Heterocyclic Carbene Complex
Losada, Iria Bolaño LU ; Ryde, Ulf LU
and Persson, Petter
LU
(2025)
In Journal of the American Chemical Society
147(35).
p.31509-31520
- Contribution to journal › Article
-
Mark
Quantum refinement in real and reciprocal space
(2025)
- Thesis › Doctoral thesis (compilation)
-
Mark
Unraveling the conformational landscape of amyloid precursor protein intracellular domain
- Contribution to journal › Article
-
Mark
Captivating bimolecular photoredox dynamics of a ligand-to-metal charge transfer complex
Wegeberg, Christina LU ; Calvet, Neus A. LU
; Krafft, Mila
LU
; Chábera, Pavel
LU
; Yartsev, Arkady
LU
and Persson, Petter
LU
(2025)
In Chemical Science
16(46).
p.21975-21990
- Contribution to journal › Article