Manohar Murthi wrote:
hi all
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
difficulties?
thanks
mo
ps - i'm using gromacs v.3.3. is 3.3.1 any better in
this regard?
no, this is still as an unsolved bug in bugzilla (66).
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