[gmx-users] calculate the dihed torsion energy

王珍 348363213 at qq.com
Tue Jul 12 10:13:38 CEST 2016


Hi all,
    I want to calculate the dihed torsion energy(for example the dihed of o3'-p-o5'-c5') using gromacs, how can i define the exergy_groups and how can I extract the energy?
Thank you very much.


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