| 1 |
Diffusional Encounter Rate Constants for Xanthone and 2-Naphthoic Acid by Flash Photolysis Experiments and Brownian Dynamics Simulations: Substantial Effects of Polarizability of the Triplet State
Stachurska K, Grochowski P, Antosiewicz JM
Journal of Physical Chemistry B, 123(44), 9328, 2019 |
| 2 |
Molecular dynamics with the united-residue model of polypeptide chains. I. Lagrange equations of motion and tests of numerical stability in the microcanonical mode
Khalili M, Liwo A, Rakowski F, Grochowski P, Scheraga HA
Journal of Physical Chemistry B, 109(28), 13785, 2005 |
| 3 |
Extended Hellmann-Feynman forces, canonical representations, and exponential propagators in the mixed quantum-classical molecular dynamics
Grochowski P, Lesyng B
Journal of Chemical Physics, 119(22), 11541, 2003 |
| 4 |
Quantum-Classical Molecular-Dynamics Simulations of Proton-Transfer Processes in Molecular-Complexes and in Enzymes
Bala P, Grochowski P, Lesyng B, Mccammon JA
Journal of Physical Chemistry, 100(7), 2535, 1996 |
