[gmx-users] potential across surface

[Andre Farias de Moura]

hi david,

you were able to reproduce my results regarding
the strange potential behaviour at a water slab
surface but I cannot reproduce yours: you sent
a potential.xvg file that resembles what I would
expect from my simulations, so I would like to
know how did you set up your system? and could
you send me your g_potential.c/gmx_potential.c
files, so I could check if there is anything new
in your cvs version of the code compared to my
standard version?

thanks again,

andre'

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    Dr. Andre' Farias de Moura

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

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        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

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