[gmx-users] bad bond in polymer
nicegromacs
nicegromacs at live.cl
Thu Aug 13 02:28:30 CEST 2009
Hi gmx-users,
I am building a polymer and I've added the monomer unit to the .rtp file. The final structure appears with an undesired bond between the monomer units at the extremes of the polymer.
How can I prevent the monomers at the end forming the bond?
I have read other post like http://www.mail-archive.com/gmx-users@gromacs.org/msg21133.html but can not avoid this problem .
Thank you in advance
veduardo.
Lab. de Fisicoquímica Molecular
Facultas de Ciencias
Universidad de Chile
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