Martin Olsson (Former)

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2022
Mark Bone mineral : A trojan horse for bone cancers. Efficient mitochondria targeted delivery and tumor eradication with nano hydroxyapatite containing doxorubicin
Liu, Yang ^LU ; Nadeem, Aftab ^LU ; Sebastian, Sujeesh ^LU ; Olsson, Martin A. ^LU ; Wai, Sun N. ; Styring, Emelie ^LU ; Engellau, Jacob ^LU ; Isaksson, Hanna ^LU ; Tägil, Magnus ^LU and Lidgren, Lars ^LU , et al. (2022) In Materials Today Bio 14.
- Contribution to journal › Article
2019
Mark Structure and Energetics of Ligand–Fluorine Interactions with Galectin-3 Backbone and Side-Chain Amides : Insight into Solvation Effects and Multipolar Interactions
Kumar, Rohit ^LU ; Ignjatović, Majda Misini ^LU ; Peterson, Kristoffer ^LU ; Olsson, Martin ^LU ; Leffler, Hakon ^LU ; Ryde, Ulf ^LU ; Nilsson, Ulf J. ^LU and Logan, Derek T. ^LU (2019) In ChemMedChem 14(16). p.1528-1536
- Contribution to journal › Article
Mark Interplay between Conformational Entropy and Solvation Entropy in Protein-Ligand Binding
Verteramo, Maria Luisa ^LU ; Stenström, Olof ^LU ; Ignjatović, Majda Misini ^LU ; Caldararu, Octav ^LU ; Olsson, Martin A. ^LU ; Manzoni, Francesco ^LU ; Leffler, Hakon ^LU ; Oksanen, Esko ^LU ; Logan, Derek T. ^LU and Nilsson, Ulf J. ^LU , et al. (2019) In Journal of the American Chemical Society 141(5). p.2012-2026
- Contribution to journal › Article
2018
Mark Binding free energies in the SAMPL6 octa-acid host–guest challenge calculated with MM and QM methods
Caldararu, Octav ^LU ; Olsson, Martin A. ^LU ; Misini Ignjatović, Majda ^LU ; Wang, Meiting and Ryde, Ulf ^LU (2018) In Journal of Computer-Aided Molecular Design 32(10). p.1027-1046
- Contribution to journal › Article
Mark QM/MM free-energy perturbation and other methods to estimate ligand-binding affinities
Olsson, Martin ^LU (2018)
- Thesis › Doctoral thesis (compilation)
Mark Relative Ligand-Binding Free Energies Calculated from Multiple Short QM/MM MD Simulations
Ryde, Ulf ^LU ; Olsson, Martin ^LU and Steinmann, Casper (2018) In Journal of Chemical Theory and Computation 14. p.3228-3228
- Contribution to journal › Article
Mark Binding affinities of the farnesoid X receptor in the D3R Grand Challenge 2 estimated by free-energy perturbation and docking
Olsson, Martin A. ^LU ; García-Sosa, Alfonso T. and Ryde, Ulf ^LU (2018) In Journal of Computer-Aided Molecular Design 32(1). p.211-224
- Contribution to journal › Article
2017
Mark Binding free energies in the SAMPL5 octa-acid host–guest challenge calculated with DFT-D3 and CCSD(T)
Caldararu, Octav ^LU ; Olsson, Martin A. ^LU ; Riplinger, Christoph ; Neese, Frank and Ryde, Ulf ^LU (2017) In Journal of Computer-Aided Molecular Design 31(1). p.87-106
- Contribution to journal › Article
Mark Comparison of QM/MM Methods To Obtain Ligand-Binding Free Energies
Olsson, Martin A. ^LU and Ryde, Ulf ^LU (2017) In Journal of Chemical Theory and Computation 13(5). p.2245-2253
- Contribution to journal › Article
2016
Mark Converging ligand-binding free energies obtained with free-energy perturbations at the quantum mechanical level
Olsson, Martin A. ^LU ; Söderhjelm, Pär ^LU and Ryde, Ulf ^LU (2016) In Journal of Computational Chemistry 37(17). p.1589-1600
- Contribution to journal › Article