[gmx-users] Flat-bottomed potential from user-defined reference

Cosseddu, S.M. s.m.cosseddu at vu.nl
Tue Nov 3 11:24:37 CET 2015


Dear all,

I am trying to apply a spherical flat-bottomed potential to maintain some molecules within a certain region. By default, GROMACS uses the initial coordinates as reference. Is there any way to provide different references?

Many thanks
Salvatore


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