Evaluation of nine condensed-phase force fields of the GROMOS, CHARMM, OPLS, AMBER, and OpenFF families against experimental cross-solvation free energies

Lignende værker

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  Udgivet: (2008)
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  af: Vanommeslaeghe, K., et al.
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• CHARMM-GUI Input Generator for NAMD, GROMACS, AMBER, OpenMM, and CHARMM/OpenMM Simulations Using the CHARMM36 Additive Force Field
  af: Lee, Jumin, et al.
  Udgivet: (2015)
• Polarizable Mean-Field Model of Water for Biological Simulations with Amber and Charmm force fields
  af: Leontyev, Igor V., et al.
  Udgivet: (2012)