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2019
Mark Trapping of Gas Bubbles in Water at a Finite Distance below a Water-Solid Interface
Esteso, V. ; Carretero-Palacios, S. ; Thiyam, P. ^LU ; Míguez, H. ; Parsons, D. F. ; Brevik, I. and Boström, M. (2019) In Langmuir 35(12). p.4218-4223
- Contribution to journal › Article
Mark Host-Guest Relative Binding Affinities at Density-Functional Theory Level from Semiempirical Molecular Dynamics Simulations
Wang, Meiting ; Mei, Ye and Ryde, Ulf ^LU (2019) In Journal of Chemical Theory and Computation 15(4). p.2659-2671
- Contribution to journal › Article
Mark Temperature Dependence of Intrinsically Disordered Proteins in Simulations : What are We Missing?
Jephthah, S. ^LU ; Staby, L. ; Kragelund, B. B. and Skepö, M. ^LU (2019) In Journal of Chemical Theory and Computation 15(4). p.2672-2683
- Contribution to journal › Article
Mark Refinement of protein structures using a combination of quantum-mechanical calculations with neutron and X-ray crystallographic data
Caldararu, Octav ^LU ; Manzoni, Francesco ^LU ; Oksanen, Esko ^LU ; Logan, Derek T. ^LU and Ryde, Ulf ^LU (2019) In Acta Crystallographica Section D: Structural Biology 75. p.368-380
- Contribution to journal › Article
Mark A thiocarbonate sink on the enzymatic energy landscape of aerobic CO oxidation? Answers from DFT and QM/MM models of Mo–Cu CO-dehydrogenases
Rovaletti, Anna ; Bruschi, Maurizio ; Moro, Giorgio ; Cosentino, Ugo ; Ryde, Ulf ^LU and Greco, Claudio ^LU (2019) In Journal of Catalysis p.201-205
- Contribution to journal › Article
Mark Assessing self-association of intrinsically disordered proteins by coarse-grained simulations and SAXS
Rieloff, Ellen ^LU (2019)
- Thesis › Licentiate thesis
Mark QM/MM study of the conversion of biliverdin into verdoheme by heme oxygenase
Alavi, Fatemeh Sadat ; Zahedi, Mansour ; Safari, Nasser and Ryde, Ulf ^LU (2019) In Theoretical Chemistry Accounts 138(5).
- Contribution to journal › Article
Mark How Will the Emerging Plurality of Lives Change? : How We Conceive of and Relate to Life?
Persson, Erik ^LU ; Abbott, Jessica ^LU ; Balkenius, Christian ^LU ; Cabak Rédei, Anna ^LU ; Capova, Klara Anna ^LU ; Dravins, Dainis ^LU ; Dunér, David ^LU ; Gunneflo, Markus ^LU ; Hedlund, Maria ^LU and Johansson, Mats ^LU , et al. (2019) In Challenges
- Contribution to journal › Article
Mark Dynamical Oligomerisation of Histidine Rich Intrinsically Disordered ProteinS Is Regulated through Zinc-Histidine Interactions
Cragnell, Carolina ^LU ; Staby, Lasse ; Lenton, Samuel ^LU ; Kragelund, Birthe B. and Skepö, Marie ^LU (2019) In Biomolecules 9(5).
- Contribution to journal › Article
Mark Assessing the Intricate Balance of Intermolecular Interactions upon Self-Association of Intrinsically Disordered Proteins
Rieloff, Ellen ^LU ; Tully, Mark D. and Skepö, Marie ^LU (2019) In Journal of Molecular Biology 431(3). p.511-523
- Contribution to journal › Article

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