[gmx-users] electrostatics forces and van der waals forces calculation

Andy Chao achao at energiaq.com
Sat Jul 26 03:46:50 CEST 2014


Dear GROMACS Users:

Would you please let me know how to calculate/extract the electrostatic
forces and van der waals forces of an ionic liquid structure in GROMACS?
 Which GROMACS command should I use?  g_enemat?  g_potential?

Thanks a lot!

Andy


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