[gmx-users] Query about use of coulombtype for LIE in gromacs

devawati dutta devawatidutta at gmail.com
Wed Jan 5 09:55:35 CET 2011


Dear Sir,
              Thanks for your prompt answer. In LIE method, if I will not
use the PME for coulombtype, then what is suitable for it? In gromacs
manual, there are several options under coulomb type.Which one I will select
for coulombtype and Vdwtype in .mdp file?

Your's sincerely
Devawati Dutta
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