X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=blobdiff_plain;f=src%2Fgromacs%2Ftrajectoryanalysis%2Fmodules%2Fsasa.cpp;h=2d14a8f00c921635513b6d098af88abd6745fd8f;hb=d140ff68d87ca3c962308fc03dadd4d99cdd9459;hp=edff30830f3311f17a373206b4b51f39ceddcca0;hpb=5750bfe806310856448a1e7baf46a7d648d1185e;p=alexxy%2Fgromacs.git diff --git a/src/gromacs/trajectoryanalysis/modules/sasa.cpp b/src/gromacs/trajectoryanalysis/modules/sasa.cpp index edff30830f..2d14a8f00c 100644 --- a/src/gromacs/trajectoryanalysis/modules/sasa.cpp +++ b/src/gromacs/trajectoryanalysis/modules/sasa.cpp @@ -60,7 +60,7 @@ #include "gromacs/math/vec.h" #include "gromacs/options/basicoptions.h" #include "gromacs/options/filenameoption.h" -#include "gromacs/options/options.h" +#include "gromacs/options/ioptionscontainer.h" #include "gromacs/pbcutil/pbc.h" #include "gromacs/selection/selection.h" #include "gromacs/selection/selectionoption.h" @@ -287,7 +287,7 @@ class Sasa : public TrajectoryAnalysisModule public: Sasa(); - virtual void initOptions(Options *options, + virtual void initOptions(IOptionsContainer *options, TrajectoryAnalysisSettings *settings); virtual void initAnalysis(const TrajectoryAnalysisSettings &settings, const TopologyInformation &top); @@ -406,7 +406,7 @@ Sasa::Sasa() } void -Sasa::initOptions(Options *options, TrajectoryAnalysisSettings *settings) +Sasa::initOptions(IOptionsContainer *options, TrajectoryAnalysisSettings *settings) { static const char *const desc[] = { "[THISMODULE] computes solvent accessible surface areas.",