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2023
Mark Two local minima for structures of [4Fe–4S] clusters obtained with density functional theory methods
Jafari, Sonia ; Ryde, Ulf ^LU and Irani, Mehdi ^LU (2023) In Scientific Reports 13(1).
- Contribution to journal › Article
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 Comparison of force fields to study the zinc-finger containing protein NPL4, a target for disulfiram in cancer therapy
Scrima, Simone ; Tiberti, Matteo ; Ryde, Ulf ^LU ; Lambrughi, Matteo and Papaleo, Elena (2023) In Biochimica et Biophysica Acta - Proteins and Proteomics 1871(4).
- Contribution to journal › Article
Mark Chemometrics in Protein Formulation : Stability Governed by Repulsion and Protein Unfolding
Kulakova, Alina ; Augustijn, Dillen ; El Bialy, Inas ; Gentiluomo, Lorenzo ; Greco, Maria Laura ; Hervø-Hansen, Stefan ^LU ; Indrakumar, Sowmya ; Mahapatra, Sujata ; Martinez Morales, Marcello and Pohl, Christin ^LU , et al. (2023) In Molecular Pharmaceutics 20(6). p.2951-2965
- Contribution to journal › Article
Mark (2963) Proposal to reject the name Rubus pseudoidaeus (Rosaceae)
van de Beek, Abraham ; Drenckhahn, Detlev ; DeVriese, Hendrik ; Gregor, Thomas ; van den Ham, Erik ; Haveman, Rense ; Hohla, Michael ; Kiraly, Gergely ; Kosiński, Piotr and Matzke-Hajek, Günter , et al. (2023) In Taxon 72(3). p.672-673
- Contribution to journal › Debate/Note/Editorial
Mark Complex Linear Response Functions for a Multiconfigurational Self-Consistent Field Wave Function in a High Performance Computing Environment
Scott, Mikael ^LU and Delcey, Mickael G ^LU (2023) In Journal of Chemical Theory and Computation 19(17). p.5924-5937
- Contribution to journal › Article
Mark Ion and Site Correlations of Charge Regulating Surfaces : A Simple and Accurate Theory
Trulsson, Martin ^LU (2023) In Langmuir 39(22). p.7642-7647
- Contribution to journal › Article
Mark N2 binding to the E0–E4 states of nitrogenase
Jiang, Hao ^LU and Ryde, Ulf ^LU (2023) In Dalton Transactions 52(26). p.9104-9120
- Contribution to journal › Article
Mark Competing dynamics of intramolecular deactivation and bimolecular charge transfer processes in luminescent Fe(iii) N-heterocyclic carbene complexes
Rosemann, Nils W. ^LU ; Lindh, Linnea ^LU ; Bolaño Losada, Iria ^LU ; Kaufhold, Simon ^LU ; Prakash, Om ^LU ; Ilic, Aleksandra ^LU ; Schwarz, Jesper ^LU ; Wärnmark, Kenneth ^LU ; Chábera, Pavel ^LU and Yartsev, Arkady ^LU , et al. (2023) In Chemical Science 14(13). p.3569-3579
- Contribution to journal › Article

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