[gmx-users] 1-4 interactions

Vitaly V. Chaban vvchaban at gmail.com
Sat Sep 26 07:51:03 CEST 2009


Is it possible in gromacs to make 1-4 interaction energy reduced as
compared to the intermolecular interations between the same centers?
In other words, I want the INTRAmolecular interaction A-B to be by
some factor smaller than INTERmolecular A-B interactions in the box.


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