[gmx-users] Charmm to Gromacs: Polyols force field [Mark]
fileti at ufabc.edu.br
Mon Aug 23 19:22:38 CEST 2010
Hello Mark thanks for the comments,
In fact, what I did was insert the parameters into ffbonded.itp file.
What I presented the link above is just the part that I had added
(of course there is the line 1495, not shown!).
The installation where I started making the change is new,
I have not changed anything, just added the lines for the parameters
Nevertheless, you think I need to re-install the gromacs?
Eudes Eterno Fileti
Centro de Ciências Naturais e Humanas
Universidade Federal do ABC — CCNH
Av. dos Estados, 5001
Santo André - SP - Brasil
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