[gmx-users] g_energy averages don't match xmgrace values

[Andre Farias de Moura]

dear berk,

just for you to be sure it's not a precision issue we are talking
about: another simulation gives average surface tension of 257.7
bar/nm using g_energy and 1804 bar/nm using grace and energy.xvg
file. that's certainly not a difference due to precision!

thanks again,

andre'

/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/

    Dr. Andre' Farias de Moura

/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/

  Laboratorio de Quimica Teorica
Universidade Federal de Sao Carlos
     Sao Carlos - SP - Brasil

/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/

        Endereco Atual

    Grupo de Quimica Quantica
Instituto de Quimica de Sao Carlos
    Universidade de Sao Paulo
    Sao Carlos - SP - Brasil
    Telefone: 55-16-3373-8055

/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/