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luisand's Reinhardt [3 articles]

Recent papers posted to luisand's library by the author Reinhardt. You can also see everyone's Reinhardt.
  • A finite-time variational method for determining optimal paths and obtaining bounds on free energy changes from computer simulations
    The Journal of Chemical Physics, Vol. 99, No. 9. (1993), pp. 6856-6864.
    by John, William P Reinhardt, Thomas F Davis
    posted to molecular_dynamics free_energy by luisand on 2008-09-05 16:47:18 as **
  • Why Is It So Difficult To Simulate Entropies, Free Energies, and Their Differences?
    Acc. Chem. Res., Vol. 34, No. 7. (17 July 2001), pp. 607-614.
    by WP Reinhardt, MA Miller, LM Amon
    posted to free_energy molecular_dynamics phase_transition by luisand on 2007-12-19 21:55:38 as **
  • Efficient free energy calculations by variationally optimized metric scaling: Concepts and applications to the volume dependence of cluster free energies and to solid--solid phase transitions
    The Journal of Chemical Physics, Vol. 113, No. 17. (2000), pp. 7035-7046.
    by Mark A Miller, William P Reinhardt
    posted to free_energy molecular_dynamics by luisand on 2007-11-28 11:18:27 as **
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