[gmx-users] g_rdf & graph edges
sir_donald_bradman at yahoo.com
Fri May 19 21:57:00 CEST 2006
i encounter a "Fatal error:
More than 4 graph edges per atom" when using g_rdf on
a trajectory that was generated using 'pbc=full'.
berk hess correctly stated that pbc=full circumvents
this problem in mdrun, but i've not seen any news of
this behaviour with the analysis programs.
has anyone else encuontered/worked around similar
ps - i'm using gromacs v.3.3. is 3.3.1 any better in
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