[gmx-users] g_energy Kinetic Energy

2012-03-08 Thread Hovakim Grabski
Dear Gromacs users, After running two different simulations, one Hypercin molecule solvated in water and the other one with 2 Hypericin molecules solved in water as well. After that   I used g_energy to extract the kinetic energy of the first simulation,but the values are  pretty high (it's

Re: [gmx-users] g_energy Kinetic Energy

2012-03-08 Thread Justin A. Lemkul
Hovakim Grabski wrote: Dear Gromacs users, After running two different simulations, one Hypercin molecule solvated in water and the other one with 2 Hypericin molecules solved in water as well. After that I used g_energy to extract the kinetic energy of the first simulation,but the values