X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=blobdiff_plain;f=src%2Fgromacs%2Fgmxana%2Fgmx_genpr.cpp;fp=src%2Fgromacs%2Fgmxana%2Fgmx_genpr.c;h=579721d4579921fe69aa68b61d40c298344dfc7e;hb=c3f2d46e4047f0c465f7234b3784a2fa6f02a065;hp=6d275cfa83969abfd17c381e86289f614665406e;hpb=0595b4a4c763a0bc574658992081abf8b0abc3fe;p=alexxy%2Fgromacs.git diff --git a/src/gromacs/gmxana/gmx_genpr.c b/src/gromacs/gmxana/gmx_genpr.cpp similarity index 98% rename from src/gromacs/gmxana/gmx_genpr.c rename to src/gromacs/gmxana/gmx_genpr.cpp index 6d275cfa83..579721d457 100644 --- a/src/gromacs/gmxana/gmx_genpr.c +++ b/src/gromacs/gmxana/gmx_genpr.cpp @@ -36,8 +36,10 @@ */ #include "gmxpre.h" -#include -#include +#include +#include + +#include #include "gromacs/commandline/pargs.h" #include "gromacs/fileio/confio.h" @@ -220,13 +222,13 @@ int gmx_genpr(int argc, char *argv[]) { if (disre_frac > 0) { - dd = min(disre_dist, disre_frac*d); + dd = std::min(disre_dist, disre_frac*d); } else { dd = disre_dist; } - lo = max(0, d-dd); + lo = std::max(static_cast(0.0), d-dd); hi = d+dd; fprintf(out, "%5d %5d %1d %5d %10d %10g %10g %10g %10g\n", ind_grp[i]+1, ind_grp[j]+1, 1, k, 1,