[gmx-users] scaling non-bonded interactions

Kukol, Andreas a.kukol at herts.ac.uk
Wed Jun 1 10:59:15 CEST 2011


Hello, 

Is it possible to globally scale all non-bonded interactions by a factor ?  I know there are energy exclusion groups, but that is an all or nothing approach, while I would like to reduce non-bonded interaction potentials to e.g. 10% of their normal value.

If this is not possible, I suggest to have this as an option in the mdp-file.

Many thanks
Andreas



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