[gmx-users] Internal coordinates to the topology
Eudes Fileti
fileti at iq.usp.br
Fri Sep 1 20:38:17 CEST 2006
Dear gmx users
I have a crystalline cell with 150 atoms.
Somebody would know to say me
as to generate the pairs (bond), triple (angles)
and quaternios (dihedrals) for the archive top?
I already used PRODRG but I have not sucess...
Thanks in advance.
eef
______________________________________
Eudes Eterno Fileti
Centro de Ciência Naturais e Humanas
Universidade Federal do ABC
Rua Santa Adélia, 166
CEP 09210-170
skype: eefileti
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