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2018
Mark Protein-water interactions studied by molecular dynamics simulations
Persson, Filip ^LU (2018)
- Thesis › Doctoral thesis (compilation)
Mark Designing interactions by control of protein-ligand complex conformation : Tuning arginine-arene interaction geometry for enhanced electrostatic protein-ligand interactions
Noresson, A. L. ^LU ; Aurelius, O. ^LU ; Öberg, C. T. ^LU ; Engström, O. ; Sundin, A. P. ^LU ; Håkansson, M. ; Stenström, O. ^LU ; Akke, M. ^LU ; Logan, D. T. ^LU and Leffler, H. ^LU , et al. (2018) In Chemical Science 9(4). p.1014-1021
- Contribution to journal › Article
Mark Elucidation of Hydrogen Bonding Patterns in Ligand-Free, Lactose- and Glycerol-Bound Galectin-3C by Neutron Crystallography to Guide Drug Design
Manzoni, Francesco ^LU ; Wallerstein, Johan ^LU ; Schrader, Tobias E ; Ostermann, Andreas ; Coates, Leighton ; Akke, Mikael ^LU ; Blakeley, Matthew P ; Oksanen, Esko ^LU and Logan, Derek T ^LU (2018) In Journal of Medicinal Chemistry 61(10). p.4412-4420
- Contribution to journal › Article
Mark Compressibility of the protein-water interface
Persson, Filip ^LU and Halle, Bertil ^LU (2018) In Journal of Chemical Physics 148(21).
- Contribution to journal › Article
Mark How proteins modify water dynamics
Persson, Filip ^LU ; Söderhjelm, Pär ^LU and Halle, Bertil ^LU (2018) In Journal of Chemical Physics 148(21).
- Contribution to journal › Article
Mark The geometry of protein hydration
Persson, Filip ^LU ; Söderhjelm, Pär ^LU and Halle, Bertil ^LU (2018) In Journal of Chemical Physics 148(21).
- Contribution to journal › Article
Mark The spatial range of protein hydration
Persson, Filip ^LU ; Söderhjelm, Pär ^LU and Halle, Bertil ^LU (2018) In Journal of Chemical Physics 148(21).
- Contribution to journal › Article
2017
Mark Site-selective ¹³C labeling of proteins using erythrose
Weininger, Ulrich ^LU (2017) In Journal of Biomolecular NMR 67(3). p.191-200
- Contribution to journal › Article
Mark Resolving the problem of trapped water in binding cavities : prediction of host–guest binding free energies in the SAMPL5 challenge by funnel metadynamics
Bhakat, Soumendranath ^LU and Söderhjelm, Pär ^LU (2017) In Journal of Computer-Aided Molecular Design p.119-132
- Contribution to journal › Article
Mark Theory of water-proton spin relaxation in complex biological systems
Chang, Zhiwei ^LU (2017)
- Thesis › Doctoral thesis (compilation)

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