diff --git a/doc/Section_tools.html b/doc/Section_tools.html index c6b44e6fb2..6a4eea174a 100644 --- a/doc/Section_tools.html +++ b/doc/Section_tools.html @@ -54,6 +54,7 @@ own sub-directories with their own Makefiles.
  • eam generate
  • eff
  • emacs +
  • fep
  • ipp
  • kate
  • lmp2arc @@ -236,6 +237,19 @@ with various highlighting options setup.


    +

    fep tool +

    +

    The tools/fep directory contains Python scripts useful for +post-processing results from performing free-energy perturbation +simulations using the USER-FEP package. +

    +

    The scripts were contributed by Agilio Padua (Université Blaise +Pascal Clermont-Ferrand), agilio.padua at univ-bpclermont.fr. +

    +

    See README file in the tools/fep directory. +

    +
    +

    ipp tool

    The tools/ipp directory contains a Perl script ipp which can be used diff --git a/doc/Section_tools.txt b/doc/Section_tools.txt index 1d0772b96b..956b475866 100644 --- a/doc/Section_tools.txt +++ b/doc/Section_tools.txt @@ -50,6 +50,7 @@ own sub-directories with their own Makefiles. "eam generate"_#eamgn "eff"_#eff "emacs"_#emacs +"fep"_#fep "ipp"_#ipp "kate"_#kate "lmp2arc"_#arc @@ -232,6 +233,19 @@ These tools were provided by Aidan Thompson at Sandia :line +fep tool :h4,link(fep) + +The tools/fep directory contains Python scripts useful for +post-processing results from performing free-energy perturbation +simulations using the USER-FEP package. + +The scripts were contributed by Agilio Padua (Université Blaise +Pascal Clermont-Ferrand), agilio.padua at univ-bpclermont.fr. + +See README file in the tools/fep directory. + +:line + ipp tool :h4,link(ipp) The tools/ipp directory contains a Perl script ipp which can be used