[gmx-users] MDP parameters for OPLS-aa + Verlet cutoff scheme

[Jernej Zidar]

Hi everyone,
  I would like to run some protein simulations using the OPLS-aa
forcefield and I'm wondering what would the "correct" parameters be.
Is there a set of agreed-upon parameters that are safe to use?

  After some research I found a set of parameters here:
https://github.com/orbeckst/GromacsWrapper/blob/master/gromacs/templates/md_OPLSAA_gpu.mdp

  Are those "safe" to use?

Thanks in advance!

Jernej Zidar