Physical and theoretical chemistry

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2023
Mark Excited-State Dynamics in a DNA-Stabilized Ag₁₆ Cluster with Near-Infrared Emission
Chen, Junsheng ; Kumar, Ajeet ; Cerretani, Cecilia ; Vosch, Tom ; Zigmantas, Donatas ^LU and Thyrhaug, Erling ^LU (2023) In Journal of Physical Chemistry Letters 14(17). p.4078-4083
- Contribution to journal › Article
Mark MultiPsi : A python-driven MCSCF program for photochemistry and spectroscopy simulations on modern HPC environments
Delcey, Mickaël G. ^LU (2023) In Wiley Interdisciplinary Reviews: Computational Molecular Science 13(6).
- Contribution to journal › Article
Mark Creation of distinctive Bax-lipid complexes at mitochondrial membrane surfaces drives pore formation to initiate apoptosis
Clifton, Luke A. ; Wacklin-Knecht, Hanna P. ^LU ; Ådén, Jörgen ; Ul Mushtaq, Ameeq ; Sparrman, Tobias and Gröbner, Gerhard (2023) In Science Advances 9(22).
- Contribution to journal › Article
Mark The OpenMolcas Web : A Community-Driven Approach to Advancing Computational Chemistry
Li Manni, Giovanni ; Aquilante, Francesco ^LU ; Delcey, Mickael ^LU ; De Vico, Luca ^LU ; Guo, Meiyuan ^LU ; Nguyen, Vu ; Veryazov, Valera ^LU ; Zhou, Chen and Lindh, Roland ^LU (2023) In Journal of Chemical Theory and Computation 19(20). p.6933-6991
- Contribution to journal › Article
Mark Diffusive intracellular interactions : On the role of protein net charge and functional adaptation
Vallina Estrada, Eloy ; Zhang, Nannan ; Wennerström, Håkan ^LU ; Danielsson, Jens and Oliveberg, Mikael (2023) In Current Opinion in Structural Biology 81.
- Contribution to journal › Scientific review
Mark Molecular Mobility in Keratin-Rich Materials Monitored by Nuclear Magnetic Resonance : A Tool for the Evaluation of Structure-Giving Properties
Gunnarsson, Maria ^LU ; Larsson, Sandra ^LU ; Malak, Monika ; Ericson, Marica B. ; Topgaard, Daniel ^LU and Sparr, Emma ^LU (2023) In Biomacromolecules 24(6). p.2661-2673
- Contribution to journal › Article
Mark Free-energy studies of ligand-binding affinities
Ekberg, Vilhelm ^LU (2023)
- Thesis › Doctoral thesis (compilation)
Mark Chloride-Based Additive Engineering for Efficient and Stable Wide-Bandgap Perovskite Solar Cells
Shen, Xinyi ; Gallant, Benjamin M. ; Holzhey, Philippe ; Smith, Joel A. ; Elmestekawy, Karim A. ; Yuan, Zhongcheng ; Rathnayake, P. V.G.M. ; Bernardi, Stefano ; Dasgupta, Akash and Kasparavicius, Ernestas , et al. (2023) In Advanced Materials 35(30).
- Contribution to journal › Article
Mark Investigating thermally induced aggregation of Somatropin- new insights using orthogonal techniques
Västberg, Amanda ^LU ; Bolinsson, Hans ^LU ; Leeman, Mats ^LU ; Nilsson, Lars ^LU ; Nylander, Tommy ^LU ; Sejwal, Kushal ; Sintorn, Ida Maria ; Lidayová, Kristina ; Sjögren, Helen ^LU and Wahlgren, Marie ^LU , et al. (2023) In International Journal of Pharmaceutics 637.
- Contribution to journal › Article
Mark Multidimensional encoding of restricted and anisotropic diffusion by double rotation of the q vector
Jiang, Hong ^LU ; Svenningsson, Leo ^LU and Topgaard, Daniel ^LU (2023) In Magnetic Resonance 4(1). p.73-85
- Contribution to journal › Article

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Publications

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