In gromacs energy file, we use to get the below energy. My question, how can i get vander waals energy and electrostatic energy from them.

 [Bond], [Angle],  [Proper Dih.], [Improper Dih.], [LJ-14],  [Coulomb-14] , [LJ (SR)], [Disper. corr.], [Coulomb (SR)], [Coul. recip.], [Potential], [Kinetic En.], [Total Energy]

I am assuming that

vander waals =  LJ-14 + LJ (SR) + Disper. corr

Electrostatic = Coulomb-14 + Coulomb (SR) + Coul. recip.

Am I right? If no, Please help me to figure out this.

More Mohammad Zahidul Hossain Khan's questions See All
Similar questions and discussions