Dear Users,
I am not sure if I understood properly how P-LINCS should parametrized for
simulation. In manual it's written that "one coordinate communication step is
required for the initial LINCS step and one for each iteration"; so as
coordinate communication is tightly binded to neighbor searching, does it mean
that nstlist should equal "1"? I mean - should neighbor list be updated every
simulation step for proper use of constraints in parallel with LINCS?
I have searched for the answers in mailing list, but I was unsuccesful in
finding tone.
Thanks in advance,
Slawek--
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