Pär Söderhjelm

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2013
Mark Comparison of MM/GBSA calculations based on explicit and implicit solvent simulations.
Godschalk, Frithjof ; Genheden, Samuel ^LU ; Söderhjelm, Pär ^LU and Ryde, Ulf ^LU (2013) In Physical Chemistry Chemical Physics 15(20). p.7731-7739
- Contribution to journal › Article
2012
Mark Transferability of conformational dependent charges from protein simulations
Genheden, Samuel ^LU ; Söderhjelm, Pär ^LU and Ryde, Ulf ^LU (2012) In International Journal of Quantum Chemistry 112(7). p.1768-1785
- Contribution to journal › Article
Mark Quantum mechanics in structure-based ligand design
Söderhjelm, Pär ^LU ; Genheden, Samuel ^LU and Ryde, Ulf ^LU (2012) In Methods and principles in medicinal chemistry 53. p.121-143
- Chapter in Book/Report/Conference proceeding › Book chapter
2011
Mark Conformational Dependence of Isotropic Polarizabilities
Söderhjelm, Pär ^LU ; Kongsted, Jacob ^LU and Ryde, Ulf ^LU (2011) In Journal of Chemical Theory and Computation 7(5). p.1404-1414
- Contribution to journal › Article
2010
Mark Estimates of ligand-binding affinities supported by quantum mechanical methods.
Söderhjelm, Pär ^LU ; Kongsted, Jacob ^LU ; Genheden, Samuel ^LU and Ryde, Ulf ^LU (2010) In Interdisciplinary sciences, computational life sciences 2(1). p.21-37
- Contribution to journal › Article
Mark Nonpolar Solvation Free Energies of Protein-Ligand Complexes
Genheden, Samuel ^LU ; Kongsted, Jacob ^LU ; Söderhjelm, Pär ^LU and Ryde, Ulf ^LU (2010) In Journal of Chemical Theory and Computation 6(11). p.3558-3568
- Contribution to journal › Article
Mark Ligand affinities estimated by quantum chemical calculations
Söderhjelm, Pär ^LU ; Kongsted, Jacob ^LU and Ryde, Ulf ^LU (2010) In Journal of Chemical Theory and Computation 6(5). p.1726-1737
- Contribution to journal › Article
2009
Mark Protein Influence on Electronic Spectra Modeled by Multipoles and Polarizabilities
Söderhjelm, Pär ^LU ; Husberg, Charlotte ; Strambi, Angela ; Olivucci, Massimo and Ryde, Ulf ^LU (2009) In Journal of Chemical Theory and Computation 5(3). p.649-658
- Contribution to journal › Article
Mark Conformational dependence of charges in protein simulations
Söderhjelm, Pär ^LU and Ryde, Ulf ^LU (2009) In Journal of Computational Chemistry 30(5). p.750-760
- Contribution to journal › Article
Mark On the coupling of intermolecular polarization and repulsion through pseudo-potentials
Söderhjelm, Pär ^LU and Öhrn, Anders ^LU (2009) In Chemical Physics Letters 468(1-3). p.94-99
- Contribution to journal › Article