| 1 |
Hoogsteen and stacked structures of the 9-methyladenine center dot center dot center dot 1-methylthymine pair are populated equally at experimental conditions: Ab initio and molecular dynamics study
Ryjacek F, Engkvist O, Vacek J, Kratochvil M, Hobza P
Journal of Physical Chemistry A, 105(7), 1197, 2001 |
| 2 |
Accurate intermolecular potentials obtained from molecular wave functions: Bridging the gap between quantum chemistry and molecular simulations
Engkvist O, Astrand PO, Karlstrom G
Chemical Reviews, 100(11), 4087, 2000 |
| 3 |
Adsorption of water on the NaCl(001) surface. III. Monte Carlo simulations at ambient temperatures
Engkvist O, Stone AJ
Journal of Chemical Physics, 112(15), 6827, 2000 |
| 4 |
Benzene trimer and benzene tetramer: Structures and properties determined by the nonempirical model (NEMO) potential calibrated from the CCSD(T) benzene dimer energies
Engkvist O, Hobza P, Selzle HL, Schlag EW
Journal of Chemical Physics, 110(12), 5758, 1999 |
| 5 |
Adsorption of water on NaCl(001). I. Intermolecular potentials and low temperature structures
Engkvist O, Stone AJ
Journal of Chemical Physics, 110(24), 12089, 1999 |
| 6 |
Uracil dimer : Potential energy and free energy surfaces. Ab initio beyond Hartree-Fock and empirical potential studies
Kratochvil M, Engkvist O, Sponer J, Jungwirth P, Hobza P
Journal of Physical Chemistry A, 102(35), 6921, 1998 |
| 7 |
A Monte-Carlo Simulation Study of the Temperature-Dependence for the Conformation Distribution of 1,2-Dimethoxyethane in Water
Engkvist O, Karlstrom G
Journal of Chemical Physics, 106(6), 2411, 1997 |
| 8 |
Monte-Carlo Simulation Study of Short Poly(Ethylene Oxide) Chains at Different Concentrations
Engkvist O, Karlstrom G
Journal of Physical Chemistry B, 101(9), 1631, 1997 |
| 9 |
Intermolecular Potential for the 1,2-Dimethoxyethane-Water Complex
Engkvist O, Astrand PO, Karlstrom G
Journal of Physical Chemistry, 100(17), 6950, 1996 |
