[gmx-users] difference in rvdw , rlist parameters in em and nvt steps

Mahboobe Sadr sadr.mahboobe1989 at gmail.com
Thu Feb 11 09:46:26 CET 2016

Dear all users,

In mdp files in ligand tutorial,  rvdw,rlist.are equal to 1 in em step,.
And are equal to 1.4 in nvt,npt and production md

When we can set different interaction parameters for different step?

Best regards

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