[gmx-users] about force fields
gurbulakoguz at yahoo.com
Wed Mar 4 17:58:56 CET 2009
I'm planing to do md simulations for n-alkane molecules. I use Gromacs 4.0.4. I tried to use oplsaa, but I couldn't create .gro and top files. I created my pdb file using Chem3d. I want to ask if I can use oplsaa for n-alkanes. And could you suggest me some force fields that can be used for n-alkanes molecules ?
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