[gmx-users] absent pairs

Milton Taidi Sonoda msonoda at iqm.unicamp.br
Mon Jan 26 19:34:01 CET 2004


Hi all
I'm simutating a single 1,2-methanediol in a periodic box
with OPLS forcefield.
I've noted that the pairs of sites HO-HC were absent while all
the other pairs were present in
the pairs section of the topology file automatically generated
with pdb2gmx. Is it rigth?
thank you in advance
Milton Taidi Sonoda






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