[gmx-users] Questions about urea.itp

Lee Soin nomadoro at gmail.com
Thu Mar 12 07:39:59 CET 2009


Hello!
Can the GROMACS topology file urea.itp be used with the OPLS force field?
In urea.itp there are two sets of parameters, separated by "#ifdef"
directives. Which set should be used?
Thanks!

-- 
SUN Li
Department of Physics
Nanjing University, China
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