14 results on '"Lyubartsev, Alexander P."'
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2. Neutron scattering study of polyamorphic THF · 17(H2O) – toward a generalized picture of amorphous states and structures derived from clathrate hydrates
3. Water structure, dynamics and reactivity on a TiO2-nanoparticle surface: new insights from ab initio molecular dynamics
4. First principles characterisation of bio–nano interface
5. Structural investigation of three distinct amorphous forms of Ar hydrate
6. Modelling of interactions between Aβ(25–35) peptide and phospholipid bilayers: effects of cholesterol and lipid saturation
7. Cholesterol in phospholipid bilayers: positions and orientations inside membranes with different unsaturation degrees
8. Curvature sensing by cardiolipin in simulated buckled membranes
9. Quantum chemical and molecular dynamics modelling of hydroxylated polybrominated diphenyl ethers
10. Reactive wetting properties of TiO2 nanoparticles predicted by ab initio molecular dynamics simulations
11. Implicit inclusion of atomic polarization in modeling of partitioning between water and lipid bilayers
12. The polyelectrolyte properties of chromatin
13. Recent development in computer simulations of lipid bilayers
14. Effective solvent mediated potentials of Na+ and Cl− ions in aqueous solution: temperature dependence
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