[gmx-users] Coul-LR

Nguyen Hoang Phuong phuong at theochem.uni-frankfurt.de
Mon Jun 20 14:32:21 CEST 2005



Dear All,

I would like to calculate the electrostatics potential of waters acting on
one atom of the solute. Gromacs only provides the short-range interaction
potential Coul-SR. Does anyone know how to get the Coul-LR?

Thanks in advance,

Phuong




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